Geometry & MOs

Info

ID:	188814
PubChem CID:	77770023
Reduced:	N2O3C13H18 (1)
Stoich.:	A2B3C13D18 (1)
Weight, g/mol:	582.30535
ΔH_f, kcal/mol:	-114.91
Dipole, Da:	4.58
IP(EA), eV:	-9.72(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[[3-[(2-amino-4-methylpentanoyl)-phenylmethoxycarbonylamino]-2-oxopropyl]-benzylamino]-3-methyl-5-oxopentyl]carbamic acid

Drug info:

PubChemData

Smile

CCC(C(=O)OCC1=CC=CC=C1)NC(=O)CN

DOS

IR

Vibrations