Geometry & MOs

Info

ID:	338674
PubChem CID:	127259685
Reduced:	NO2C20H21 (1)
Stoich.:	AB2C20D21 (1)
Weight, g/mol:	316.117155
ΔH_f, kcal/mol:	-24.52
Dipole, Da:	6.53
IP(EA), eV:	-9.62(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethoxy-4-[(E)-2-(1-methyl-5-nitroimidazol-2-yl)ethenyl]benzamide

Drug info:

PubChemData

Smile

CCCCN(C(=O)/C=C/C1=CC=CC=C1)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations