Cyanocobalt; [(2R,3S,4R,5S)-5-(5,6-Dimethylbenzimidazol-1-Yl)-4-Hydroxy-2-(Hydroxymethyl)Tetrahydrofuran-3-Yl] [(1S)-1-Methyl-2-[3-[(2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-2,13,18-Tris(2-Amino-2-Oxo-Ethyl)-7,12,17-Tris(3-Amino-3-Oxo-Propyl)-3,5,8,8,13,15,18,19-Octamethyl-2,7,12,17-Tetrahydrocorrin-3-Yl]Propanoylamino]Ethyl] Hydrogen Phosphate

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Properties Simple | Detailed

Formula C63H88CoN14O14P
IUPAC Name cyanocobalt;[(2r,3s,4r,5s)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl] [(1s)-1-methyl-2-[3-[(2r,3r,4z,7s,9z,12s,13s,14z,17s,18s,19r)-2,13,18-tris(2-amino-2-oxo-ethyl)-7,12,17-tris(3-amino-3-oxo-propyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydrocorrin-3-yl]propanoylamino]ethyl] hydrogen phosphate
Molecular Mass 1355.365 g·mol−1
Heat of Formation 5606.5 ± 16.7 kJ·mol−1
Dipole Moment 17.58 ± 1.08 D
Volume 1273.96 Å 3
Surface Area 905.0 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy -4.56 ± eV
Point Group Symmetry C1
InChIKey HZHGWVYPLXMINV-BYLSPCLQSA-N
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