Geometry & MOs

Info

ID:	254322
PubChem CID:	103124293
Reduced:	O3N4C13H22 (1)
Stoich.:	A3B4C13D22 (1)
Weight, g/mol:	268.025084
ΔH_f, kcal/mol:	-93.9
Dipole, Da:	2.97
IP(EA), eV:	-9.08(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-methoxy-4-(2-oxo-1H-imidazol-3-yl)benzoic acid

Drug info:

PubChemData

Smile

CC(C(C)O)N1C(=C(N=N1)C(=O)OC)C2CCNCC2

DOS

IR

Vibrations