CuC14N3H10O4(CH)3 crystallizes in the triclinic P-1 space group. The structure consists of twenty-four 02329_fluka molecules inside a CuC14N3H10O4 framework. In the CuC14N3H10O4 framework, there are four inequivalent Cu sites. In the first Cu site, Cu(1) is bonded in a distorted square pyramidal geometry to one N(5), one O(13), one O(4), one O(7), and one O(9) atom. The Cu(1)-N(5) bond length is 1.94 Å. The Cu(1)-O(13) bond length is 1.95 Å. The Cu(1)-O(4) bond length is 2.02 Å. The Cu(1)-O(7) bond length is 2.46 Å. The Cu(1)-O(9) bond length is 1.91 Å. In the second Cu site, Cu(2) is bonded in a distorted square pyramidal geometry to one N(6), one O(10), one O(14), one O(3), and one O(8) atom. The Cu(2)-N(6) bond length is 1.94 Å. The Cu(2)-O(10) bond length is 1.91 Å. The Cu(2)-O(14) bond length is 1.95 Å. The Cu(2)-O(3) bond length is 2.02 Å. The Cu(2)-O(8) bond length is 2.46 Å. In the third Cu site, Cu(3) is bonded in a distorted square pyramidal geometry to one N(7), one O(1), one O(11), one O(15), and one O(6) atom. The Cu(3)-N(7) bond length is 1.94 Å. The Cu(3)-O(1) bond length is 2.02 Å. The Cu(3)-O(11) bond length is 1.91 Å. The Cu(3)-O(15) bond length is 1.95 Å. The Cu(3)-O(6) bond length is 2.46 Å. In the fourth Cu site, Cu(4) is bonded in a distorted square pyramidal geometry to one N(8), one O(12), one O(16), one O(2), and one O(5) atom. The Cu(4)-N(8) bond length is 1.94 Å. The Cu(4)-O(12) bond length is 1.91 Å. The Cu(4)-O(16) bond length is 1.95 Å. The Cu(4)-O(2) bond length is 2.02 Å. The Cu(4)-O(5) bond length is 2.46 Å. There are forty inequivalent C sites. In the first C site, C(1) is bonded in a distorted trigonal planar geometry to one C(17,18,19); one C(21,22,23,24); and one N(5) atom. The C(1)-C(17,18,19) bond length is 1.42 Å. The C(1)-C(21,22,23,24) bond length is 1.41 Å. The C(1)-N(5) bond length is 1.42 Å. In the second C site, C(2) is bonded in a distorted trigonal planar geometry to one C(17,18,19); one C(21,22,23,24); and one N(6) atom. The C(2)-C(17,18,19) bond length is 1.42 Å. The C(2)-C(21,22,23,24) bond length is 1.41 Å. The C(2)-N(6) bond length is 1.42 Å. In the third C site, C(3) is bonded in a distorted trigonal planar geometry to one C(17,18,19); one C(21,22,23,24); and one N(7) atom. The C(3)-C(17,18,19) bond length is 1.42 Å. The C(3)-C(21,22,23,24) bond length is 1.41 Å. The C(3)-N(7) bond length is 1.42 Å. In the fourth C site, C(4) is bonded in a distorted trigonal planar geometry to one C(20); one C(21,22,23,24); and one N(8) atom. The C(4)-C(20) bond length is 1.42 Å. The C(4)-C(21,22,23,24) bond length is 1.41 Å. The C(4)-N(8) bond length is 1.42 Å. In the fifth C site, C(5) is bonded in a distorted trigonal planar geometry to one C(41), one C(45), and one N(9) atom. The C(5)-C(41) bond length is 1.41 Å. The C(5)-C(45) bond length is 1.41 Å. The C(5)-N(9) bond length is 1.41 Å. In the sixth C site, C(6) is bonded in a distorted trigonal planar geometry to one C(42), one C(46), and one N(10) atom. The C(6)-C(42) bond length is 1.41 Å. The C(6)-C(46) bond length is 1.41 Å. The C(6)-N(10) bond length is 1.41 Å. In the seventh C site, C(7) is bonded in a distorted trigonal planar geometry to one C(43,44); one C(47,48); and one N(11) atom. The C(7)-C(43,44) bond length is 1.41 Å. The C(7)-C(47,48) bond length is 1.41 Å. The C(7)-N(11) bond length is 1.41 Å. In the eighth C site, C(8) is bonded in a distorted trigonal planar geometry to one C(43,44); one C(47,48); and one N(12) atom. The C(8)-C(43,44) bond length is 1.41 Å. The C(8)-C(47,48) bond length is 1.41 Å. The C(8)-N(12) bond length is 1.41 Å. In the ninth C site, C(9,11) is bonded in a distorted single-bond geometry to one C(13), one C(37), and one N(1) atom. The C(9,11)-C(13) bond length is 1.46 Å. The C(9,11)-C(37) bond length is 1.47 Å. The C(9,11)-N(1) bond length is 1.33 Å. In the tenth C site, C(10) is bonded in a distorted single-bond geometry to one C(14); one C(38); and one N(2,3) atom. The C(10)-C(14) bond length is 1.46 Å. The C(10)-C(38) bond length is 1.47 Å. The C(10)-N(2,3) bond length is 1.33 Å. In the eleventh C site, C(12) is bonded in a distorted single-bond geometry to one C(16), one C(40), and one N(4) atom. The C(12)-C(16) bond length is 1.46 Å. The C(12)-C(40) bond length is 1.47 Å. The C(12)-N(4) bond length is 1.33 Å. In the twelfth C site, C(13) is bonded in a distorted trigonal planar geometry to one C(65,67); one C(9,11); and one O(5) atom. The C(13)-C(65,67) bond length is 1.51 Å. The C(13)-O(5) bond length is 1.25 Å. In the thirteenth C site, C(14) is bonded in a distorted trigonal planar geometry to one C(10), one C(66), and one O(6) atom. The C(14)-C(66) bond length is 1.51 Å. The C(14)-O(6) bond length is 1.25 Å. In the fourteenth C site, C(15) is bonded in a distorted trigonal planar geometry to one C(65,67); one C(9,11); and one O(7) atom. The C(15)-C(65,67) bond length is 1.51 Å. The C(15)-C(9,11) bond length is 1.46 Å. The C(15)-O(7) bond length is 1.25 Å. In the fifteenth C site, C(16) is bonded in a distorted trigonal planar geometry to one C(12), one C(68), and one O(8) atom. The C(16)-C(68) bond length is 1.51 Å. The C(16)-O(8) bond length is 1.25 Å. In the sixteenth C site, C(17,18,19) is bonded in a trigonal planar geometry to one C(1); one C(25); and one C(29,31,32) atom. The C(17,18,19)-C(25) bond length is 1.49 Å. The C(17,18,19)-C(29,31,32) bond length is 1.41 Å. In the seventeenth C site, C(20) is bonded in a trigonal planar geometry to one C(28); one C(29,31,32); and one C(4) atom. The C(20)-C(28) bond length is 1.49 Å. The C(20)-C(29,31,32) bond length is 1.41 Å. In the eighteenth C site, C(21,22,23,24) is bonded in a distorted trigonal planar geometry to one C(1); one C(49,50,51,52); and one H(1,2,3,4) atom. The C(21,22,23,24)-C(49,50,51,52) bond length is 1.38 Å. The C(21,22,23,24)-H(1,2,3,4) bond length is 1.09 Å. In the nineteenth C site, C(25) is bonded in a distorted bent 120 degrees geometry to one C(17,18,19); one O(1); and one O(9) atom. The C(25)-O(1) bond length is 1.27 Å. The C(25)-O(9) bond length is 1.28 Å. In the twentieth C site, C(26) is bonded in a distorted bent 120 degrees geometry to one C(17,18,19); one O(10); and one O(2) atom. The C(26)-C(17,18,19) bond length is 1.49 Å. The C(26)-O(10) bond length is 1.28 Å. The C(26)-O(2) bond length is 1.27 Å. In the twenty-first C site, C(27) is bonded in a distorted bent 120 degrees geometry to one C(17,18,19); one O(11); and one O(3) atom. The C(27)-C(17,18,19) bond length is 1.49 Å. The C(27)-O(11) bond length is 1.28 Å. The C(27)-O(3) bond length is 1.27 Å. In the twenty-second C site, C(28) is bonded in a distorted bent 120 degrees geometry to one C(20), one O(12), and one O(4) atom. The C(28)-O(12) bond length is 1.28 Å. The C(28)-O(4) bond length is 1.27 Å. In the twenty-third C site, C(29,31,32) is bonded in a distorted single-bond geometry to one C(17,18,19) and one H(5,6,7,8) atom. The C(29,31,32)-H(5,6,7,8) bond length is 1.09 Å. In the twenty-fourth C site, C(30) is bonded in a distorted single-bond geometry to one C(17,18,19) and one H(5,6,7,8) atom. The C(30)-C(17,18,19) bond length is 1.41 Å. The C(30)-H(5,6,7,8) bond length is 1.09 Å. In the twenty-fifth C site, C(33,34) is bonded in a distorted single-bond geometry to one C(41) and one H(9) atom. The C(33,34)-C(41) bond length is 1.39 Å. The C(33,34)-H(9) bond length is 1.09 Å. In the twenty-sixth C site, C(35,36) is bonded in a distorted single-bond geometry to one C(43,44) and one H(10,11,12) atom. The C(35,36)-C(43,44) bond length is 1.39 Å. The C(35,36)-H(10,11,12) bond length is 1.09 Å. In the twenty-seventh C site, C(37) is bonded in a distorted trigonal planar geometry to one C(9,11); one N(9); and one O(13) atom. The C(37)-N(9) bond length is 1.35 Å. The C(37)-O(13) bond length is 1.27 Å. In the twenty-eighth C site, C(38) is bonded in a distorted trigonal planar geometry to one C(10), one N(10), and one O(14) atom. The C(38)-N(10) bond length is 1.35 Å. The C(38)-O(14) bond length is 1.27 Å. In the twenty-ninth C site, C(39) is bonded in a distorted trigonal planar geometry to one C(9,11); one N(11); and one O(15) atom. The C(39)-C(9,11) bond length is 1.47 Å. The C(39)-N(11) bond length is 1.35 Å. The C(39)-O(15) bond length is 1.27 Å. In the thirtieth C site, C(40) is bonded in a distorted trigonal planar geometry to one C(12), one N(12), and one O(16) atom. The C(40)-N(12) bond length is 1.35 Å. The C(40)-O(16) bond length is 1.27 Å. In the thirty-first C site, C(41) is bonded in a distorted trigonal planar geometry to one C(33,34); one C(5); and one H(13,14) atom. The C(41)-H(13,14) bond length is 1.08 Å. In the thirty-second C site, C(42) is bonded in a distorted trigonal planar geometry to one C(33,34); one C(6); and one H(13,14) atom. The C(42)-C(33,34) bond length is 1.39 Å. The C(42)-H(13,14) bond length is 1.08 Å. In the thirty-third C site, C(43,44) is bonded in a distorted trigonal planar geometry to one C(35,36); one C(7); and one H(15,16) atom. The C(43,44)-H(15,16) bond length is 1.08 Å. In the thirty-fourth C site, C(45) is bonded in a distorted single-bond geometry to one C(5) and one H(17,18) atom. The C(45)-H(17,18) bond length is 1.09 Å. In the thirty-fifth C site, C(46) is bonded in a distorted single-bond geometry to one C(6) and one H(17,18) atom. The C(46)-H(17,18) bond length is 1.09 Å. In the thirty-sixth C site, C(47,48) is bonded in a distorted single-bond geometry to one C(7) and one H(19,20) atom. The C(47,48)-H(19,20) bond length is 1.09 Å. In the thirty-seventh C site, C(49,50,51,52) is bonded in a distorted single-bond geometry to one C(21,22,23,24) and one H(21,22,23,24) atom. The C(49,50,51,52)-H(21,22,23,24) bond length is 1.09 Å. In the thirty-eighth C site, C(65,67) is bonded in a trigonal non-coplanar geometry to one C(13); one H(37,38,39,40); one H(41,42,43,44); and one H(45,46,47,48) atom. The C(65,67)-H(37,38,39,40) bond length is 1.10 Å. The C(65,67)-H(41,42,43,44) bond length is 1.10 Å. The C(65,67)-H(45,46,47,48) bond length is 1.09 Å. In the thirty-ninth C site, C(66) is bonded in a trigonal non-coplanar geometry to one C(14); one H(37,38,39,40); one H(41,42,43,44); and one H(45,46,47,48) atom. The C(66)-H(37,38,39,40) bond length is 1.10 Å. The C(66)-H(41,42,43,44) bond length is 1.10 Å. The C(66)-H(45,46,47,48) bond length is 1.09 Å. In the fortieth C site, C(68) is bonded in a trigonal non-coplanar geometry to one C(16); one H(37,38,39,40); one H(41,42,43,44); and one H(45,46,47,48) atom. The C(68)-H(37,38,39,40) bond length is 1.10 Å. The C(68)-H(41,42,43,44) bond length is 1.10 Å. The C(68)-H(45,46,47,48) bond length is 1.09 Å. There are eleven inequivalent N sites. In the first N site, N(1) is bonded in a distorted bent 120 degrees geometry to one C(9,11) and one N(5) atom. The N(1)-N(5) bond length is 1.29 Å. In the second N site, N(2,3) is bonded in a distorted bent 120 degrees geometry to one C(10) and one N(6) atom. The N(2,3)-N(6) bond length is 1.29 Å. In the third N site, N(4) is bonded in a distorted bent 120 degrees geometry to one C(12) and one N(8) atom. The N(4)-N(8) bond length is 1.29 Å. In the fourth N site, N(5) is bonded in a trigonal planar geometry to one Cu(1), one C(1), and one N(1) atom. In the fifth N site, N(6) is bonded in a trigonal planar geometry to one Cu(2); one C(2); and one N(2,3) atom. In the sixth N site, N(7) is bonded in a trigonal planar geometry to one Cu(3); one C(3); and one N(2,3) atom. The N(7)-N(2,3) bond length is 1.29 Å. In the seventh N site, N(8) is bonded in a trigonal planar geometry to one Cu(4), one C(4), and one N(4) atom. In the eighth N site, N(9) is bonded in a trigonal planar geometry to one C(37), one C(5), and one H(49) atom. The N(9)-H(49) bond length is 1.04 Å. In the ninth N site, N(10) is bonded in a trigonal planar geometry to one C(38), one C(6), and one H(50) atom. The N(10)-H(50) bond length is 1.04 Å. In the tenth N site, N(11) is bonded in a trigonal planar geometry to one C(39), one C(7), and one H(51) atom. The N(11)-H(51) bond length is 1.04 Å. In the eleventh N site, N(12) is bonded in a trigonal planar geometry to one C(40), one C(8), and one H(52) atom. The N(12)-H(52) bond length is 1.04 Å. There are sixteen inequivalent H sites. In the first H site, H(1,2,3,4) is bonded in a single-bond geometry to one C(21,22,23,24) atom. In the second H site, H(5,6,7,8) is bonded in a single-bond geometry to one C(29,31,32) atom. In the third H site, H(9) is bonded in a single-bond geometry to one C(33,34) atom. In the fourth H site, H(10,11,12) is bonded in a single-bond geometry to one C(33,34) atom. The H(10,11,12)-C(33,34) bond length is 1.09 Å. In the fifth H site, H(13,14) is bonded in a single-bond geometry to one C(41) atom. In the sixth H site, H(15,16) is bonded in a single-bond geometry to one C(43,44) atom. In the seventh H site, H(17,18) is bonded in a single-bond geometry to one C(45) atom. In the eighth H site, H(19,20) is bonded in a single-bond geometry to one C(47,48) atom. In the ninth H site, H(21,22,23,24) is bonded in a single-bond geometry to one C(49,50,51,52) atom. In the tenth H site, H(37,38,39,40) is bonded in a single-bond geometry to one C(65,67) atom. In the eleventh H site, H(41,42,43,44) is bonded in a single-bond geometry to one C(65,67) atom. In the twelfth H site, H(45,46,47,48) is bonded in a single-bond geometry to one C(65,67) atom. In the thirteenth H site, H(49) is bonded in a distorted single-bond geometry to one N(9) and one O(5) atom. The H(49)-O(5) bond length is 1.72 Å. In the fourteenth H site, H(50) is bonded in a distorted single-bond geometry to one N(10) and one O(6) atom. The H(50)-O(6) bond length is 1.72 Å. In the fifteenth H site, H(51) is bonded in a distorted single-bond geometry to one N(11) and one O(7) atom. The H(51)-O(7) bond length is 1.72 Å. In the sixteenth H site, H(52) is bonded in a distorted single-bond geometry to one N(12) and one O(8) atom. The H(52)-O(8) bond length is 1.72 Å. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Cu(3) and one C(25) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Cu(4) and one C(26) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Cu(2) and one C(27) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(28) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one Cu(4), one C(13), and one H(49) atom. In the sixth O site, O(6) is bonded in a distorted single-bond geometry to one Cu(3), one C(14), and one H(50) atom. In the seventh O site, O(7) is bonded in a distorted single-bond geometry to one Cu(1), one C(15), and one H(51) atom. In the eighth O site, O(8) is bonded in a distorted single-bond geometry to one Cu(2), one C(16), and one H(52) atom. In the ninth O site, O(9) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(25) atom. In the tenth O site, O(10) is bonded in a bent 120 degrees geometry to one Cu(2) and one C(26) atom. In the eleventh O site, O(11) is bonded in a bent 120 degrees geometry to one Cu(3) and one C(27) atom. In the twelfth O site, O(12) is bonded in a bent 120 degrees geometry to one Cu(4) and one C(28) atom. In the thirteenth O site, O(13) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(37) atom. In the fourteenth O site, O(14) is bonded in a bent 120 degrees geometry to one Cu(2) and one C(38) atom. In the fifteenth O site, O(15) is bonded in a bent 120 degrees geometry to one Cu(3) and one C(39) atom. In the sixteenth O site, O(16) is bonded in a bent 120 degrees geometry to one Cu(4) and one C(40) atom. Linkers: 8 CC(=O)/C(=N/[N]c1ccccc1C([O])=O)C(=O)Nc1ccccc1. Metal clusters: 8 [Cu]. The MOF has largest included sphere 4.37 A, density 1.33 g/cm3, surface area 4511.93 m2/g, accessible volume 0.25 cm3/g