Geometry & MOs

Info

ID:	339949
PubChem CID:	127261958
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	482.231791
ΔH_f, kcal/mol:	-125.52
Dipole, Da:	6.32
IP(EA), eV:	-9.26(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(2R)-2-amino-3-(1-formylindol-3-yl)propanoyl]-2-[benzyl(methyl)amino]-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N

DOS

IR

Vibrations