Geometry & MOs

Info

ID:	62949
PubChem CID:	26737760
Reduced:	N2O3C14H16 (1)
Stoich.:	A2B3C14D16 (1)
Weight, g/mol:	389.137556
ΔH_f, kcal/mol:	-31.1
Dipole, Da:	5.4
IP(EA), eV:	-9.32(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(2-methyl-3-nitrophenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)[C@@H]2CCC=CC2

DOS

IR

Vibrations