Geometry & MOs

Info

ID:	338672
PubChem CID:	127259683
Reduced:	N2O3H14C19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	344.148455
ΔH_f, kcal/mol:	-36.99
Dipole, Da:	7.62
IP(EA), eV:	-9.31(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2C3=CC=CC=N3)C(=O)O

DOS

IR

Vibrations