Geometry & MOs

Info

ID:	380539
PubChem CID:	134971020
Reduced:	O3N4C18H22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-83.07
Dipole, Da:	4.62
IP(EA), eV:	-9.32(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(2S)-3-(1H-imidazol-5-yl)-1-oxo-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)[C@H](CC2=CN=CN2)NC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations