Geometry & MOs

Info

ID:	39783
PubChem CID:	8142271
Reduced:	NO2H21C23 (1)
Stoich.:	AB2C21D23 (1)
Weight, g/mol:	362.126657
ΔH_f, kcal/mol:	4.86
Dipole, Da:	2.73
IP(EA), eV:	-8.73(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(R)-(4-methoxyphenyl)-phenylmethyl]-4-nitrobenzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@@H](C2=CC=CC=C2)NC(=O)/C=C/C3=CC=CC=C3

DOS

IR

Vibrations