Geometry & MOs

Info

ID:	130502
PubChem CID:	51090977
Reduced:	N3O4C17H21 (1)
Stoich.:	A3B4C17D21 (1)
Weight, g/mol:	329.137556
ΔH_f, kcal/mol:	-107.74
Dipole, Da:	3.45
IP(EA), eV:	-9.43(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyethyl)-4-methyl-3-nitro-N-(pyridin-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC(C(=O)N(CCOC)CC1=CC=CC=N1)NC(=O)C2=CC=CO2

DOS

IR

Vibrations