Li5H46(C10N3)3(CH)12C3NH7 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of eight 02329_fluka molecules; two cis-1,3-pentadiene molecules; two propylene molecules; two trimethylamine molecules; and two Li5H46(C10N3)3 clusters. In each Li5H46(C10N3)3 cluster, there are five inequivalent Li sites. In the first Li site, Li(1) is bonded in a trigonal planar geometry to one N(2), one N(6), and one N(7) atom. The Li(1)-N(2) bond length is 2.03 Å. The Li(1)-N(6) bond length is 1.95 Å. The Li(1)-N(7) bond length is 2.05 Å. In the second Li site, Li(2) is bonded in a 5-coordinate geometry to one N(3), one N(6), one N(7), one N(8), and one H(48) atom. The Li(2)-N(3) bond length is 2.13 Å. The Li(2)-N(6) bond length is 2.06 Å. The Li(2)-N(7) bond length is 2.12 Å. The Li(2)-N(8) bond length is 2.11 Å. The Li(2)-H(48) bond length is 2.12 Å. In the third Li site, Li(3) is bonded in a distorted tetrahedral geometry to one N(10), one N(7), one N(8), and one N(9) atom. The Li(3)-N(10) bond length is 2.02 Å. The Li(3)-N(7) bond length is 2.15 Å. The Li(3)-N(8) bond length is 2.06 Å. The Li(3)-N(9) bond length is 2.19 Å. In the fourth Li site, Li(4) is bonded in a trigonal planar geometry to one N(4), one N(8), and one N(9) atom. The Li(4)-N(4) bond length is 2.04 Å. The Li(4)-N(8) bond length is 2.00 Å. The Li(4)-N(9) bond length is 2.02 Å. In the fifth Li site, Li(5) is bonded in a distorted trigonal planar geometry to one N(10), one N(5), and one N(9) atom. The Li(5)-N(10) bond length is 1.97 Å. The Li(5)-N(5) bond length is 2.05 Å. The Li(5)-N(9) bond length is 2.01 Å. There are thirty inequivalent C sites. In the first C site, C(4) is bonded in a tetrahedral geometry to one N(2), one H(10), one H(8), and one H(9) atom. The C(4)-N(2) bond length is 1.47 Å. The C(4)-H(10) bond length is 1.10 Å. The C(4)-H(8) bond length is 1.10 Å. The C(4)-H(9) bond length is 1.10 Å. In the second C site, C(5) is bonded in a distorted trigonal non-coplanar geometry to one N(2), one H(11), and one H(12) atom. The C(5)-N(2) bond length is 1.47 Å. The C(5)-H(11) bond length is 1.10 Å. The C(5)-H(12) bond length is 1.11 Å. In the third C site, C(6) is bonded in a distorted trigonal non-coplanar geometry to one N(2), one H(13), and one H(14) atom. The C(6)-N(2) bond length is 1.47 Å. The C(6)-H(13) bond length is 1.11 Å. The C(6)-H(14) bond length is 1.10 Å. In the fourth C site, C(7) is bonded in a tetrahedral geometry to one N(3), one H(15), one H(16), and one H(17) atom. The C(7)-N(3) bond length is 1.47 Å. The C(7)-H(15) bond length is 1.10 Å. The C(7)-H(16) bond length is 1.10 Å. The C(7)-H(17) bond length is 1.11 Å. In the fifth C site, C(8) is bonded in a distorted trigonal non-coplanar geometry to one N(3), one H(18), and one H(19) atom. The C(8)-N(3) bond length is 1.47 Å. The C(8)-H(18) bond length is 1.10 Å. The C(8)-H(19) bond length is 1.11 Å. In the sixth C site, C(9) is bonded in a distorted trigonal non-coplanar geometry to one N(3), one H(20), and one H(21) atom. The C(9)-N(3) bond length is 1.47 Å. The C(9)-H(20) bond length is 1.10 Å. The C(9)-H(21) bond length is 1.10 Å. In the seventh C site, C(10) is bonded in a tetrahedral geometry to one N(4), one H(22), one H(23), and one H(24) atom. The C(10)-N(4) bond length is 1.47 Å. The C(10)-H(22) bond length is 1.10 Å. The C(10)-H(23) bond length is 1.11 Å. The C(10)-H(24) bond length is 1.10 Å. In the eighth C site, C(11) is bonded in a distorted trigonal non-coplanar geometry to one N(4); one H(25); and one H(26,28) atom. The C(11)-N(4) bond length is 1.48 Å. The C(11)-H(25) bond length is 1.11 Å. The C(11)-H(26,28) bond length is 1.10 Å. In the ninth C site, C(12) is bonded in a distorted trigonal non-coplanar geometry to one N(4); one H(26,28); and one H(27) atom. The C(12)-N(4) bond length is 1.48 Å. The C(12)-H(26,28) bond length is 1.10 Å. The C(12)-H(27) bond length is 1.10 Å. In the tenth C site, C(13) is bonded in a tetrahedral geometry to one N(5), one H(29), one H(30), and one H(31) atom. The C(13)-N(5) bond length is 1.47 Å. The C(13)-H(29) bond length is 1.10 Å. The C(13)-H(30) bond length is 1.10 Å. The C(13)-H(31) bond length is 1.10 Å. In the eleventh C site, C(14) is bonded in a distorted trigonal non-coplanar geometry to one N(5), one H(32), and one H(33) atom. The C(14)-N(5) bond length is 1.48 Å. The C(14)-H(32) bond length is 1.10 Å. The C(14)-H(33) bond length is 1.11 Å. In the twelfth C site, C(15) is bonded in a distorted trigonal non-coplanar geometry to one N(5), one H(34), and one H(35) atom. The C(15)-N(5) bond length is 1.48 Å. The C(15)-H(34) bond length is 1.11 Å. The C(15)-H(35) bond length is 1.10 Å. In the thirteenth C site, C(16) is bonded in a distorted trigonal planar geometry to one C(17), one C(21), and one N(6) atom. The C(16)-C(17) bond length is 1.43 Å. The C(16)-C(21) bond length is 1.43 Å. The C(16)-N(6) bond length is 1.37 Å. In the fourteenth C site, C(17) is bonded in a distorted trigonal planar geometry to one C(16), one C(18), and one H(37) atom. The C(17)-C(18) bond length is 1.39 Å. The C(17)-H(37) bond length is 1.09 Å. In the fifteenth C site, C(18) is bonded in a distorted single-bond geometry to one C(17) and one H(38) atom. The C(18)-H(38) bond length is 1.09 Å. In the sixteenth C site, C(21) is bonded in a distorted single-bond geometry to one C(16) and one H(41) atom. The C(21)-H(41) bond length is 1.09 Å. In the seventeenth C site, C(22) is bonded in a distorted single-bond geometry to one N(7) atom. The C(22)-N(7) bond length is 1.38 Å. In the eighteenth C site, C(28) is bonded in a distorted trigonal planar geometry to one C(29), one C(33), and one N(8) atom. The C(28)-C(29) bond length is 1.42 Å. The C(28)-C(33) bond length is 1.42 Å. The C(28)-N(8) bond length is 1.39 Å. In the nineteenth C site, C(29) is bonded in a distorted trigonal planar geometry to one C(28), one C(30), and one H(49) atom. The C(29)-C(30) bond length is 1.39 Å. The C(29)-H(49) bond length is 1.09 Å. In the twentieth C site, C(30) is bonded in a distorted trigonal planar geometry to one C(29), one C(31), and one H(50) atom. The C(30)-C(31) bond length is 1.40 Å. The C(30)-H(50) bond length is 1.09 Å. In the twenty-first C site, C(31) is bonded in a distorted trigonal planar geometry to one C(30), one C(32), and one H(51) atom. The C(31)-C(32) bond length is 1.40 Å. The C(31)-H(51) bond length is 1.09 Å. In the twenty-second C site, C(32) is bonded in a distorted single-bond geometry to one C(31), one C(33), and one H(52) atom. The C(32)-C(33) bond length is 1.40 Å. The C(32)-H(52) bond length is 1.09 Å. In the twenty-third C site, C(33) is bonded in a distorted trigonal planar geometry to one C(28), one C(32), and one H(53) atom. The C(33)-H(53) bond length is 1.09 Å. In the twenty-fourth C site, C(34) is bonded in a distorted single-bond geometry to one N(9) atom. The C(34)-N(9) bond length is 1.38 Å. In the twenty-fifth C site, C(40) is bonded in a distorted trigonal planar geometry to one C(41), one C(45), and one N(10) atom. The C(40)-C(41) bond length is 1.42 Å. The C(40)-C(45) bond length is 1.42 Å. The C(40)-N(10) bond length is 1.37 Å. In the twenty-sixth C site, C(41) is bonded in a distorted single-bond geometry to one C(40), one C(42), and one H(61) atom. The C(41)-C(42) bond length is 1.39 Å. The C(41)-H(61) bond length is 1.09 Å. In the twenty-seventh C site, C(42) is bonded in a distorted trigonal planar geometry to one C(41), one C(43), and one H(62) atom. The C(42)-C(43) bond length is 1.40 Å. The C(42)-H(62) bond length is 1.09 Å. In the twenty-eighth C site, C(43) is bonded in a distorted trigonal planar geometry to one C(42), one C(44), and one H(63) atom. The C(43)-C(44) bond length is 1.40 Å. The C(43)-H(63) bond length is 1.09 Å. In the twenty-ninth C site, C(44) is bonded in a distorted single-bond geometry to one C(43) and one H(64) atom. The C(44)-H(64) bond length is 1.09 Å. In the thirtieth C site, C(45) is bonded in a distorted single-bond geometry to one C(40) and one H(65) atom. The C(45)-H(65) bond length is 1.09 Å. There are nine inequivalent N sites. In the first N site, N(2) is bonded to one Li(1), one C(4), one C(5), and one C(6) atom to form corner-sharing NLiC3 tetrahedra. In the second N site, N(3) is bonded to one Li(2), one C(7), one C(8), and one C(9) atom to form corner-sharing NLiC3 tetrahedra. In the third N site, N(4) is bonded in a tetrahedral geometry to one Li(4), one C(10), one C(11), and one C(12) atom. In the fourth N site, N(5) is bonded to one Li(5), one C(13), one C(14), and one C(15) atom to form corner-sharing NLiC3 tetrahedra. In the fifth N site, N(6) is bonded to one Li(1), one Li(2), one C(16), and one H(36) atom to form distorted corner-sharing NLi2HC tetrahedra. The N(6)-H(36) bond length is 1.02 Å. In the sixth N site, N(7) is bonded in a 5-coordinate geometry to one Li(1), one Li(2), one Li(3), one C(22), and one H(42) atom. The N(7)-H(42) bond length is 1.02 Å. In the seventh N site, N(8) is bonded in a 5-coordinate geometry to one Li(2), one Li(3), one Li(4), one C(28), and one H(48) atom. The N(8)-H(48) bond length is 1.03 Å. In the eighth N site, N(9) is bonded in a 5-coordinate geometry to one Li(3), one Li(4), one Li(5), one C(34), and one H(54) atom. The N(9)-H(54) bond length is 1.02 Å. In the ninth N site, N(10) is bonded to one Li(3), one Li(5), one C(40), and one H(60) atom to form distorted corner-sharing NLi2HC tetrahedra. The N(10)-H(60) bond length is 1.03 Å. There are forty-five inequivalent H sites. In the first H site, H(8) is bonded in a single-bond geometry to one C(4) atom. In the second H site, H(9) is bonded in a single-bond geometry to one C(4) atom. In the third H site, H(10) is bonded in a single-bond geometry to one C(4) atom. In the fourth H site, H(11) is bonded in a single-bond geometry to one C(5) atom. In the fifth H site, H(12) is bonded in a single-bond geometry to one C(5) atom. In the sixth H site, H(13) is bonded in a single-bond geometry to one C(6) atom. In the seventh H site, H(14) is bonded in a single-bond geometry to one C(6) atom. In the eighth H site, H(15) is bonded in a single-bond geometry to one C(7) atom. In the ninth H site, H(16) is bonded in a single-bond geometry to one C(7) atom. In the tenth H site, H(17) is bonded in a single-bond geometry to one C(7) atom. In the eleventh H site, H(18) is bonded in a single-bond geometry to one C(8) atom. In the twelfth H site, H(19) is bonded in a single-bond geometry to one C(8) atom. In the thirteenth H site, H(20) is bonded in a single-bond geometry to one C(9) atom. In the fourteenth H site, H(21) is bonded in a single-bond geometry to one C(9) atom. In the fifteenth H site, H(22) is bonded in a single-bond geometry to one C(10) atom. In the sixteenth H site, H(23) is bonded in a single-bond geometry to one C(10) atom. In the seventeenth H site, H(24) is bonded in a single-bond geometry to one C(10) atom. In the eighteenth H site, H(25) is bonded in a single-bond geometry to one C(11) atom. In the nineteenth H site, H(26,28) is bonded in a single-bond geometry to one C(11) atom. In the twentieth H site, H(27) is bonded in a single-bond geometry to one C(12) atom. In the twenty-first H site, H(29) is bonded in a single-bond geometry to one C(13) atom. In the twenty-second H site, H(30) is bonded in a single-bond geometry to one C(13) atom. In the twenty-third H site, H(31) is bonded in a single-bond geometry to one C(13) atom. In the twenty-fourth H site, H(32) is bonded in a single-bond geometry to one C(14) atom. In the twenty-fifth H site, H(33) is bonded in a single-bond geometry to one C(14) atom. In the twenty-sixth H site, H(34) is bonded in a single-bond geometry to one C(15) atom. In the twenty-seventh H site, H(35) is bonded in a single-bond geometry to one C(15) atom. In the twenty-eighth H site, H(36) is bonded in a single-bond geometry to one N(6) atom. In the twenty-ninth H site, H(37) is bonded in a single-bond geometry to one C(17) atom. In the thirtieth H site, H(38) is bonded in a single-bond geometry to one C(18) atom. In the thirty-first H site, H(41) is bonded in a single-bond geometry to one C(21) atom. In the thirty-second H site, H(42) is bonded in a single-bond geometry to one N(7) atom. In the thirty-third H site, H(48) is bonded in a single-bond geometry to one Li(2) and one N(8) atom. In the thirty-fourth H site, H(49) is bonded in a single-bond geometry to one C(29) atom. In the thirty-fifth H site, H(50) is bonded in a single-bond geometry to one C(30) atom. In the thirty-sixth H site, H(51) is bonded in a single-bond geometry to one C(31) atom. In the thirty-seventh H site, H(52) is bonded in a single-bond geometry to one C(32) atom. In the thirty-eighth H site, H(53) is bonded in a single-bond geometry to one C(33) atom. In the thirty-ninth H site, H(54) is bonded in a single-bond geometry to one N(9) atom. In the fortieth H site, H(60) is bonded in a single-bond geometry to one N(10) atom. In the forty-first H site, H(61) is bonded in a single-bond geometry to one C(41) atom. In the forty-second H site, H(62) is bonded in a single-bond geometry to one C(42) atom. In the forty-third H site, H(63) is bonded in a single-bond geometry to one C(43) atom. In the forty-fourth H site, H(64) is bonded in a single-bond geometry to one C(44) atom. In the forty-fifth H site, H(65) is bonded in a single-bond geometry to one C(45) atom. Linkers: 3 CN1CCN(C)CC1. Metal clusters: 10 [Li]. The MOF has largest included sphere 4.60 A, density 0.98 g/cm3, surface area 6126.25 m2/g, accessible volume 0.32 cm3/g