N-(3-{[(Benzyloxy)Carbonyl]Amino}-4-Cyclohexyl-2-Oxobutanoyl)-5-(Carbamimidoylammonio)Norvalyl-N-(1-Carboxylato-2-Cyclohexylethyl)-5-Oxido-5-Oxonorvalinamidato

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Properties Simple | Detailed

Formula C38H56N7O10-
IUPAC Name (4r)-4-[[(2r)-2-[[(3s)-3-(benzyloxycarbonylamino)-4-cyclohexyl-2-oxo-butanoyl]amino]-5-(diaminomethyleneammonio)pentanoyl]amino]-5-[[(1s)-1-carboxylato-2-cyclohexyl-ethyl]amino]-5-oxo-pentanoate
Molecular Mass 770.892 g·mol−1
Heat of Formation -1950.2 ± 16.7 kJ·mol−1
Dipole Moment 7.68 ± 1.08 D
Volume 950.58 Å 3
Surface Area 782.94 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy 2.31 ± eV
Point Group Symmetry C1
InChIKey LKCWMWZIRUHWBW-ZXYZSCNASA-N
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