Geometry & MOs

Info

ID:	238953
PubChem CID:	93165769
Reduced:	ClO2N3C21H22 (1)
Stoich.:	AB2C3D21E22 (1)
Weight, g/mol:	326.163043
ΔH_f, kcal/mol:	-48.61
Dipole, Da:	4.0
IP(EA), eV:	-8.59(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(1S)-2-oxo-1-phenyl-2-(propan-2-ylamino)ethyl]carbamate

Drug info:

PubChemData

Smile

CC(C)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations