(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 C22H35N5O5
IUPAC Name [3-[[(1s)-1-[[(2s)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]carbamoyl]-2-methyl-propyl]amino]-2-oxo-propyl]-λ1-azanyl-azanide
Molecular Mass 449.544 g·mol−1
Heat of Formation -690.5 ± 16.7 kJ·mol−1
Dipole Moment 9.80 ± 1.08 D
Volume 566.06 Å 3
Surface Area 464.24 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy 2.70 ± eV
Point Group Symmetry C1
InChIKey OHPUPILWBVGOHM-OVVXSAMCSA-N
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