(2S)-2-Amino-N-[(2S)-2-Anilino-3-Phenyl-Propanoyl]-5-Guanidino-Pentanamide

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Properties Simple | Detailed

Formula C21H27N6O2T
IUPAC Name (2s)-2-amino-5-guanidino-n-[(2s)-3-phenyl-2-(4-tritioanilino)propanoyl]pentanamide
Molecular Mass 398.494 g·mol−1
Heat of Formation -176.4 ± 16.7 kJ·mol−1
Dipole Moment 7.50 ± 1.08 D
Volume 501.35 Å 3
Surface Area 376.69 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 0.06 ± eV
Point Group Symmetry C1
InChIKey BDEDHOUBLGPNIQ-CKWAGGCGSA-N
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