Geometry & MOs

Info

ID:	34199
PubChem CID:	7890257
Reduced:	ClNO4H20C22 (1)
Stoich.:	ABC4D20E22 (1)
Weight, g/mol:	301.106256
ΔH_f, kcal/mol:	-116.11
Dipole, Da:	4.67
IP(EA), eV:	-8.95(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-methyl-2-(5-nitro-2-oxopyridin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C(=O)[C@@H](C)OC(=O)C3=CC(=CC=C3)O

DOS

IR

Vibrations