Geometry & MOs

Info

ID:	137313
PubChem CID:	52189857
Reduced:	N4O5C15H16 (1)
Stoich.:	A4B5C15D16 (1)
Weight, g/mol:	385.163771
ΔH_f, kcal/mol:	-82.24
Dipole, Da:	2.15
IP(EA), eV:	-9.53(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(2,4-dimethoxyphenyl)-N-(2-methyl-3-nitrophenyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)NCC(=O)NCC2=CC=CO2

DOS

IR

Vibrations