CuC21NH18O6(CH)6C3H2 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of six 02329_fluka molecules; one 2,3-dimethyl-1,3-butadiene molecule; two propylene molecules; and one CuC21NH18O6 cluster. In the CuC21NH18O6 cluster, Cu(1) is bonded in a square pyramidal geometry to one N(1), one O(1), one O(2), one O(5), and one O(6) atom. The Cu(1)-N(1) bond length is 2.16 Å. The Cu(1)-O(1) bond length is 2.00 Å. The Cu(1)-O(2) bond length is 2.00 Å. The Cu(1)-O(5) bond length is 2.00 Å. The Cu(1)-O(6) bond length is 2.00 Å. There are twenty-one inequivalent C sites. In the first C site, C(1) is bonded in a distorted bent 120 degrees geometry to one C(2), one O(1), and one O(2) atom. The C(1)-C(2) bond length is 1.50 Å. The C(1)-O(1) bond length is 1.27 Å. The C(1)-O(2) bond length is 1.28 Å. In the second C site, C(2) is bonded in a trigonal planar geometry to one C(1), one C(3), and one C(7) atom. The C(2)-C(3) bond length is 1.40 Å. The C(2)-C(7) bond length is 1.42 Å. In the third C site, C(3) is bonded in a distorted single-bond geometry to one C(2) and one H(1) atom. The C(3)-H(1) bond length is 1.09 Å. In the fourth C site, C(7) is bonded in a distorted single-bond geometry to one C(2) and one O(3) atom. The C(7)-O(3) bond length is 1.36 Å. In the fifth C site, C(8) is bonded in a distorted trigonal non-coplanar geometry to one C(9), one H(5), one H(6), and one O(3) atom. The C(8)-C(9) bond length is 1.50 Å. The C(8)-H(5) bond length is 1.10 Å. The C(8)-H(6) bond length is 1.11 Å. The C(8)-O(3) bond length is 1.44 Å. In the sixth C site, C(9) is bonded in a trigonal planar geometry to one C(10), one C(14), and one C(8) atom. The C(9)-C(10) bond length is 1.41 Å. The C(9)-C(14) bond length is 1.41 Å. In the seventh C site, C(10) is bonded in a trigonal planar geometry to one C(11), one C(15), and one C(9) atom. The C(10)-C(11) bond length is 1.40 Å. The C(10)-C(15) bond length is 1.51 Å. In the eighth C site, C(11) is bonded in a distorted single-bond geometry to one C(10), one C(12), and one H(7) atom. The C(11)-C(12) bond length is 1.40 Å. The C(11)-H(7) bond length is 1.09 Å. In the ninth C site, C(12) is bonded in a trigonal planar geometry to one C(11), one C(13), and one C(16) atom. The C(12)-C(13) bond length is 1.41 Å. The C(12)-C(16) bond length is 1.51 Å. In the tenth C site, C(13) is bonded in a trigonal planar geometry to one C(12), one C(14), and one C(18) atom. The C(13)-C(14) bond length is 1.41 Å. The C(13)-C(18) bond length is 1.50 Å. In the eleventh C site, C(14) is bonded in a trigonal planar geometry to one C(13), one C(17), and one C(9) atom. The C(14)-C(17) bond length is 1.50 Å. In the twelfth C site, C(15) is bonded in a distorted trigonal non-coplanar geometry to one C(10), one H(10), one H(8), and one H(9) atom. The C(15)-H(10) bond length is 1.10 Å. The C(15)-H(8) bond length is 1.10 Å. The C(15)-H(9) bond length is 1.10 Å. In the thirteenth C site, C(16) is bonded in a distorted trigonal non-coplanar geometry to one C(12), one H(11), one H(12), and one H(13) atom. The C(16)-H(11) bond length is 1.10 Å. The C(16)-H(12) bond length is 1.10 Å. The C(16)-H(13) bond length is 1.10 Å. In the fourteenth C site, C(17) is bonded in a distorted trigonal non-coplanar geometry to one C(14), one H(14), one H(15), and one H(16) atom. The C(17)-H(14) bond length is 1.10 Å. The C(17)-H(15) bond length is 1.10 Å. The C(17)-H(16) bond length is 1.10 Å. In the fifteenth C site, C(18) is bonded in a distorted trigonal non-coplanar geometry to one C(13), one H(17), one H(18), and one O(4) atom. The C(18)-H(17) bond length is 1.10 Å. The C(18)-H(18) bond length is 1.10 Å. The C(18)-O(4) bond length is 1.44 Å. In the sixteenth C site, C(19) is bonded in a distorted single-bond geometry to one C(24) and one O(4) atom. The C(19)-C(24) bond length is 1.42 Å. The C(19)-O(4) bond length is 1.37 Å. In the seventeenth C site, C(23) is bonded in a distorted single-bond geometry to one C(24) and one H(22) atom. The C(23)-C(24) bond length is 1.40 Å. The C(23)-H(22) bond length is 1.09 Å. In the eighteenth C site, C(24) is bonded in a trigonal planar geometry to one C(19), one C(23), and one C(25) atom. The C(24)-C(25) bond length is 1.50 Å. In the nineteenth C site, C(25) is bonded in a distorted bent 120 degrees geometry to one C(24), one O(5), and one O(6) atom. The C(25)-O(5) bond length is 1.28 Å. The C(25)-O(6) bond length is 1.28 Å. In the twentieth C site, C(26) is bonded in a distorted bent 120 degrees geometry to one N(1) and one H(23) atom. The C(26)-N(1) bond length is 1.34 Å. The C(26)-H(23) bond length is 1.09 Å. In the twenty-first C site, C(30) is bonded in a distorted bent 120 degrees geometry to one N(1) and one H(26) atom. The C(30)-N(1) bond length is 1.34 Å. The C(30)-H(26) bond length is 1.09 Å. N(1) is bonded in a trigonal planar geometry to one Cu(1), one C(26), and one C(30) atom. There are eighteen inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(3) atom. In the second H site, H(5) is bonded in a single-bond geometry to one C(8) atom. In the third H site, H(6) is bonded in a single-bond geometry to one C(8) atom. In the fourth H site, H(7) is bonded in a single-bond geometry to one C(11) atom. In the fifth H site, H(8) is bonded in a single-bond geometry to one C(15) atom. In the sixth H site, H(9) is bonded in a single-bond geometry to one C(15) atom. In the seventh H site, H(10) is bonded in a single-bond geometry to one C(15) atom. In the eighth H site, H(11) is bonded in a single-bond geometry to one C(16) atom. In the ninth H site, H(12) is bonded in a single-bond geometry to one C(16) atom. In the tenth H site, H(13) is bonded in a single-bond geometry to one C(16) atom. In the eleventh H site, H(14) is bonded in a single-bond geometry to one C(17) atom. In the twelfth H site, H(15) is bonded in a single-bond geometry to one C(17) atom. In the thirteenth H site, H(16) is bonded in a single-bond geometry to one C(17) atom. In the fourteenth H site, H(17) is bonded in a single-bond geometry to one C(18) atom. In the fifteenth H site, H(18) is bonded in a single-bond geometry to one C(18) atom. In the sixteenth H site, H(22) is bonded in a single-bond geometry to one C(23) atom. In the seventeenth H site, H(23) is bonded in a single-bond geometry to one C(26) atom. In the eighteenth H site, H(26) is bonded in a single-bond geometry to one C(30) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(1) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one C(7) and one C(8) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one C(18) and one C(19) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(25) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Cu(1) and one C(25) atom. Linkers: 2 Cc1cc(C)c(COc2ccccc2C([O])=O)c(C)c1COc1ccccc1C([O])=O ,1 c1cc(-c2ccncc2)ccn1. Metal clusters: 1 [C]1O[Cu]234O[C]O[Cu]2(O1)(O[C]O3)O[C]O4. The MOF has largest included sphere 4.78 A, density 1.15 g/cm3, surface area 5005.39 m2/g, accessible volume 0.42 cm3/g