Geometry & MOs

Info

ID:	7251
PubChem CID:	71710
Reduced:	N3O4H11C14 (1)
Stoich.:	A3B4C11D14 (1)
Weight, g/mol:	285.074956
ΔH_f, kcal/mol:	7.72
Dipole, Da:	2.94
IP(EA), eV:	-9.87(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(1-ethenyl-5-nitroimidazol-2-yl)ethenyl]benzoic acid

Drug info:

PubChemData

Smile

C=CN1C(=CN=C1C=CC2=CC=C(C=C2)C(=O)O)[N+](=O)[O-]

DOS

IR

Vibrations