Geometry & MOs

Info

ID:	55321
PubChem CID:	17390049
Reduced:	ClNOH3C5 (2)
Stoich.:	ABCD3E5 (2)
Weight, g/mol:	218.069142
ΔH_f, kcal/mol:	-38.1
Dipole, Da:	7.3
IP(EA), eV:	-10.09(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxyphenyl)imidazole-4-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)N2C=C(N=C2)C(=O)O

DOS

IR

Vibrations