(1Z)-3-{[(2S)-1-({N-[(Benzyloxy)Carbonyl]-L-Leucyl}Amino)-3-Methyl-1-Oxo-2-Butanyl]Amino}-1-Diazonio-1-Propen-2-Olate

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Properties Simple | Detailed

Formula C22H31N5O5
IUPAC Name [3-[[(1s)-1-[[(2s)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]carbamoyl]-2-methyl-propyl]amino]-2-oxo-propyl]-λ1-azanyl-azanide
Molecular Mass 445.512 g·mol−1
Heat of Formation -633.9 ± 16.7 kJ·mol−1
Dipole Moment 7.47 ± 1.08 D
Volume 557.33 Å 3
Surface Area 489.04 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 2.25 ± eV
Point Group Symmetry C1
InChIKey OHPUPILWBVGOHM-OVVXSAMCSA-N
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