CdC24H16(NO)5CH crystallizes in the triclinic P-1 space group. The structure consists of four 02329_fluka molecules inside a CdC24H16(NO)5 framework. In the CdC24H16(NO)5 framework, there are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a 7-coordinate geometry to one N(1), one N(10), one O(10), one O(3), one O(8), and two equivalent O(1) atoms. The Cd(1)-N(1) bond length is 2.27 Å. The Cd(1)-N(10) bond length is 2.36 Å. The Cd(1)-O(10) bond length is 2.70 Å. The Cd(1)-O(3) bond length is 2.44 Å. The Cd(1)-O(8) bond length is 2.26 Å. There is one shorter (2.48 Å) and one longer (2.61 Å) Cd(1)-O(1) bond length. In the second Cd site, Cd(2) is bonded in a 7-coordinate geometry to one N(2), one N(9), one O(4), one O(7), one O(9), and two equivalent O(2) atoms. The Cd(2)-N(2) bond length is 2.27 Å. The Cd(2)-N(9) bond length is 2.36 Å. The Cd(2)-O(4) bond length is 2.45 Å. The Cd(2)-O(7) bond length is 2.26 Å. The Cd(2)-O(9) bond length is 2.70 Å. There is one shorter (2.47 Å) and one longer (2.60 Å) Cd(2)-O(2) bond length. There are forty-three inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one N(1), one N(3), and one H(1) atom. The C(1)-N(1) bond length is 1.32 Å. The C(1)-N(3) bond length is 1.37 Å. The C(1)-H(1) bond length is 1.08 Å. In the second C site, C(2) is bonded in a trigonal planar geometry to one N(2), one N(4), and one H(2) atom. The C(2)-N(2) bond length is 1.32 Å. The C(2)-N(4) bond length is 1.37 Å. The C(2)-H(2) bond length is 1.08 Å. In the third C site, C(3,4) is bonded in a distorted bent 120 degrees geometry to one C(5), one N(1), and one H(3) atom. The C(3,4)-C(5) bond length is 1.37 Å. The C(3,4)-N(1) bond length is 1.39 Å. The C(3,4)-H(3) bond length is 1.08 Å. In the fourth C site, C(5) is bonded in a distorted bent 120 degrees geometry to one C(3,4); one N(3); and one H(5,6) atom. The C(5)-N(3) bond length is 1.39 Å. The C(5)-H(5,6) bond length is 1.08 Å. In the fifth C site, C(6) is bonded in a distorted bent 120 degrees geometry to one C(3,4); one N(4); and one H(5,6) atom. The C(6)-C(3,4) bond length is 1.37 Å. The C(6)-N(4) bond length is 1.39 Å. The C(6)-H(5,6) bond length is 1.08 Å. In the sixth C site, C(7) is bonded in a distorted trigonal planar geometry to one C(15,16); one N(3); and one N(5,6) atom. The C(7)-C(15,16) bond length is 1.40 Å. The C(7)-N(3) bond length is 1.41 Å. The C(7)-N(5,6) bond length is 1.33 Å. In the seventh C site, C(8) is bonded in a distorted trigonal planar geometry to one C(15,16); one N(4); and one N(5,6) atom. The C(8)-C(15,16) bond length is 1.40 Å. The C(8)-N(4) bond length is 1.41 Å. The C(8)-N(5,6) bond length is 1.33 Å. In the eighth C site, C(9) is bonded in a distorted trigonal planar geometry to one C(11,12); one N(5,6); and one N(7) atom. The C(9)-C(11,12) bond length is 1.40 Å. The C(9)-N(5,6) bond length is 1.33 Å. The C(9)-N(7) bond length is 1.42 Å. In the ninth C site, C(10) is bonded in a distorted trigonal planar geometry to one C(11,12); one N(5,6); and one N(8) atom. The C(10)-C(11,12) bond length is 1.40 Å. The C(10)-N(5,6) bond length is 1.33 Å. The C(10)-N(8) bond length is 1.42 Å. In the tenth C site, C(11,12) is bonded in a distorted single-bond geometry to one C(13,14); one C(9); and one H(7,8) atom. The C(11,12)-C(13,14) bond length is 1.40 Å. The C(11,12)-H(7,8) bond length is 1.09 Å. In the eleventh C site, C(13,14) is bonded in a distorted trigonal planar geometry to one C(11,12); one C(15,16); and one H(9,10) atom. The C(13,14)-C(15,16) bond length is 1.39 Å. The C(13,14)-H(9,10) bond length is 1.09 Å. In the twelfth C site, C(15,16) is bonded in a distorted single-bond geometry to one C(13,14); one C(7); and one H(11,12) atom. The C(15,16)-H(11,12) bond length is 1.09 Å. In the thirteenth C site, C(17) is bonded in a distorted bent 120 degrees geometry to one C(49), one N(7), and one H(13) atom. The C(17)-C(49) bond length is 1.37 Å. The C(17)-N(7) bond length is 1.39 Å. The C(17)-H(13) bond length is 1.08 Å. In the fourteenth C site, C(18) is bonded in a distorted bent 120 degrees geometry to one C(50), one N(8), and one H(14) atom. The C(18)-C(50) bond length is 1.37 Å. The C(18)-N(8) bond length is 1.39 Å. The C(18)-H(14) bond length is 1.08 Å. In the fifteenth C site, C(19) is bonded in a trigonal planar geometry to one N(7); one N(9); and one H(15,16) atom. The C(19)-N(7) bond length is 1.37 Å. The C(19)-N(9) bond length is 1.32 Å. The C(19)-H(15,16) bond length is 1.08 Å. In the sixteenth C site, C(20) is bonded in a trigonal planar geometry to one N(10); one N(8); and one H(15,16) atom. The C(20)-N(10) bond length is 1.32 Å. The C(20)-N(8) bond length is 1.37 Å. The C(20)-H(15,16) bond length is 1.08 Å. In the seventeenth C site, C(21) is bonded in a distorted bent 120 degrees geometry to one C(23), one O(1), and one O(3) atom. The C(21)-C(23) bond length is 1.49 Å. The C(21)-O(1) bond length is 1.28 Å. The C(21)-O(3) bond length is 1.28 Å. In the eighteenth C site, C(22) is bonded in a distorted bent 120 degrees geometry to one C(24), one O(2), and one O(4) atom. The C(22)-C(24) bond length is 1.49 Å. The C(22)-O(2) bond length is 1.28 Å. The C(22)-O(4) bond length is 1.28 Å. In the nineteenth C site, C(23) is bonded in a trigonal planar geometry to one C(21), one C(25), and one C(33) atom. The C(23)-C(25) bond length is 1.40 Å. The C(23)-C(33) bond length is 1.40 Å. In the twentieth C site, C(24) is bonded in a trigonal planar geometry to one C(22), one C(26), and one C(34) atom. The C(24)-C(26) bond length is 1.40 Å. The C(24)-C(34) bond length is 1.40 Å. In the twenty-first C site, C(25) is bonded in a distorted single-bond geometry to one C(23); one C(27,28); and one H(17,18) atom. The C(25)-C(27,28) bond length is 1.39 Å. The C(25)-H(17,18) bond length is 1.09 Å. In the twenty-second C site, C(26) is bonded in a distorted single-bond geometry to one C(24); one C(27,28); and one H(17,18) atom. The C(26)-C(27,28) bond length is 1.39 Å. The C(26)-H(17,18) bond length is 1.09 Å. In the twenty-third C site, C(27,28) is bonded in a distorted trigonal planar geometry to one C(25), one C(29), and one H(19) atom. The C(27,28)-C(29) bond length is 1.40 Å. The C(27,28)-H(19) bond length is 1.09 Å. In the twenty-fourth C site, C(29) is bonded in a distorted single-bond geometry to one C(27,28) and one O(5,6) atom. The C(29)-O(5,6) bond length is 1.38 Å. In the twenty-fifth C site, C(30) is bonded in a distorted single-bond geometry to one C(27,28) and one O(5,6) atom. The C(30)-C(27,28) bond length is 1.40 Å. The C(30)-O(5,6) bond length is 1.38 Å. In the twenty-sixth C site, C(33) is bonded in a distorted single-bond geometry to one C(23) and one H(23,24) atom. The C(33)-H(23,24) bond length is 1.09 Å. In the twenty-seventh C site, C(34) is bonded in a distorted single-bond geometry to one C(24) and one H(23,24) atom. The C(34)-H(23,24) bond length is 1.09 Å. In the twenty-eighth C site, C(35) is bonded in a distorted single-bond geometry to one C(37) and one O(5,6) atom. The C(35)-C(37) bond length is 1.39 Å. The C(35)-O(5,6) bond length is 1.39 Å. In the twenty-ninth C site, C(36) is bonded in a distorted single-bond geometry to one C(38) and one O(5,6) atom. The C(36)-C(38) bond length is 1.39 Å. The C(36)-O(5,6) bond length is 1.39 Å. In the thirtieth C site, C(37) is bonded in a distorted trigonal planar geometry to one C(35); one C(39); and one H(25,26) atom. The C(37)-C(39) bond length is 1.40 Å. The C(37)-H(25,26) bond length is 1.09 Å. In the thirty-first C site, C(38) is bonded in a distorted trigonal planar geometry to one C(36); one C(40); and one H(25,26) atom. The C(38)-C(40) bond length is 1.40 Å. The C(38)-H(25,26) bond length is 1.09 Å. In the thirty-second C site, C(39) is bonded in a distorted trigonal planar geometry to one C(37), one C(41), and one H(27) atom. The C(39)-C(41) bond length is 1.40 Å. The C(39)-H(27) bond length is 1.09 Å. In the thirty-third C site, C(40) is bonded in a distorted trigonal planar geometry to one C(38), one C(42), and one H(28) atom. The C(40)-C(42) bond length is 1.40 Å. The C(40)-H(28) bond length is 1.09 Å. In the thirty-fourth C site, C(41) is bonded in a trigonal planar geometry to one C(39), one C(43), and one C(47) atom. The C(41)-C(43) bond length is 1.40 Å. The C(41)-C(47) bond length is 1.50 Å. In the thirty-fifth C site, C(42) is bonded in a trigonal planar geometry to one C(40), one C(44), and one C(48) atom. The C(42)-C(44) bond length is 1.40 Å. The C(42)-C(48) bond length is 1.50 Å. In the thirty-sixth C site, C(43) is bonded in a distorted trigonal planar geometry to one C(41), one C(45), and one H(29) atom. The C(43)-C(45) bond length is 1.39 Å. The C(43)-H(29) bond length is 1.09 Å. In the thirty-seventh C site, C(44) is bonded in a distorted trigonal planar geometry to one C(42), one C(46), and one H(30) atom. The C(44)-C(46) bond length is 1.39 Å. The C(44)-H(30) bond length is 1.09 Å. In the thirty-eighth C site, C(45) is bonded in a distorted single-bond geometry to one C(43) and one H(31) atom. The C(45)-H(31) bond length is 1.09 Å. In the thirty-ninth C site, C(46) is bonded in a distorted single-bond geometry to one C(44) and one H(32) atom. The C(46)-H(32) bond length is 1.09 Å. In the fortieth C site, C(47) is bonded in a bent 120 degrees geometry to one C(41), one O(7), and one O(9) atom. The C(47)-O(7) bond length is 1.29 Å. The C(47)-O(9) bond length is 1.26 Å. In the forty-first C site, C(48) is bonded in a bent 120 degrees geometry to one C(42), one O(10), and one O(8) atom. The C(48)-O(10) bond length is 1.26 Å. The C(48)-O(8) bond length is 1.29 Å. In the forty-second C site, C(49) is bonded in a distorted bent 120 degrees geometry to one C(17); one N(9); and one H(33,34) atom. The C(49)-N(9) bond length is 1.38 Å. The C(49)-H(33,34) bond length is 1.08 Å. In the forty-third C site, C(50) is bonded in a distorted bent 120 degrees geometry to one C(18); one N(10); and one H(33,34) atom. The C(50)-N(10) bond length is 1.38 Å. The C(50)-H(33,34) bond length is 1.08 Å. There are nine inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one Cd(1); one C(1); and one C(3,4) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to one Cd(2); one C(2); and one C(3,4) atom. The N(2)-C(3,4) bond length is 1.39 Å. In the third N site, N(3) is bonded in a trigonal planar geometry to one C(1), one C(5), and one C(7) atom. In the fourth N site, N(4) is bonded in a trigonal planar geometry to one C(2), one C(6), and one C(8) atom. In the fifth N site, N(5,6) is bonded in a bent 120 degrees geometry to one C(7) and one C(9) atom. In the sixth N site, N(7) is bonded in a trigonal planar geometry to one C(17), one C(19), and one C(9) atom. In the seventh N site, N(8) is bonded in a trigonal planar geometry to one C(10), one C(18), and one C(20) atom. In the eighth N site, N(9) is bonded in a distorted trigonal planar geometry to one Cd(2), one C(19), and one C(49) atom. In the ninth N site, N(10) is bonded in a distorted trigonal planar geometry to one Cd(1), one C(20), and one C(50) atom. There are twenty-three inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(2) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(3,4) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(3,4) atom. The H(4)-C(3,4) bond length is 1.08 Å. In the fifth H site, H(5,6) is bonded in a single-bond geometry to one C(5) atom. In the sixth H site, H(7,8) is bonded in a single-bond geometry to one C(11,12) atom. In the seventh H site, H(9,10) is bonded in a single-bond geometry to one C(13,14) atom. In the eighth H site, H(11,12) is bonded in a single-bond geometry to one C(15,16) atom. In the ninth H site, H(13) is bonded in a single-bond geometry to one C(17) atom. In the tenth H site, H(14) is bonded in a single-bond geometry to one C(18) atom. In the eleventh H site, H(15,16) is bonded in a single-bond geometry to one C(19) atom. In the twelfth H site, H(17,18) is bonded in a single-bond geometry to one C(25) atom. In the thirteenth H site, H(19) is bonded in a single-bond geometry to one C(27,28) atom. In the fourteenth H site, H(20) is bonded in a single-bond geometry to one C(27,28) atom. The H(20)-C(27,28) bond length is 1.09 Å. In the fifteenth H site, H(23,24) is bonded in a single-bond geometry to one C(33) atom. In the sixteenth H site, H(25,26) is bonded in a single-bond geometry to one C(37) atom. In the seventeenth H site, H(27) is bonded in a single-bond geometry to one C(39) atom. In the eighteenth H site, H(28) is bonded in a single-bond geometry to one C(40) atom. In the nineteenth H site, H(29) is bonded in a single-bond geometry to one C(43) atom. In the twentieth H site, H(30) is bonded in a single-bond geometry to one C(44) atom. In the twenty-first H site, H(31) is bonded in a single-bond geometry to one C(45) atom. In the twenty-second H site, H(32) is bonded in a single-bond geometry to one C(46) atom. In the twenty-third H site, H(33,34) is bonded in a single-bond geometry to one C(49) atom. There are nine inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Cd(1) and one C(21) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Cd(2) and one C(22) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one Cd(1) and one C(21) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one Cd(2) and one C(22) atom. In the fifth O site, O(5,6) is bonded in a bent 120 degrees geometry to one C(29) and one C(35) atom. In the sixth O site, O(7) is bonded in a water-like geometry to one Cd(2) and one C(47) atom. In the seventh O site, O(8) is bonded in a water-like geometry to one Cd(1) and one C(48) atom. In the eighth O site, O(9) is bonded in a single-bond geometry to one Cd(2) and one C(47) atom. In the ninth O site, O(10) is bonded in a single-bond geometry to one Cd(1) and one C(48) atom. Linkers: 4 [O]C(=O)c1ccc(Oc2ccc(C([O])=O)cc2)cc1 ,4 c1cc(-n2ccnc2)nc(-n2ccnc2)c1. Metal clusters: 2 O=[C]O[Cd]1O[C]O1.O=[C]O[Cd]1O[C]O1. The MOF has largest included sphere 3.67 A, density 1.47 g/cm3, surface area 4294.38 m2/g, accessible volume 0.22 cm3/g