Geometry & MOs

Info

ID:	296038
PubChem CID:	117552176
Reduced:	N2O4H12C13 (1)
Stoich.:	A2B4C12D13 (1)
Weight, g/mol:	322.03169
ΔH_f, kcal/mol:	-110.01
Dipole, Da:	7.01
IP(EA), eV:	-8.67(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(4-bromophenyl)-5-methyl-1H-imidazol-2-yl]butanoic acid

Drug info:

PubChemData

Smile

CC1=C(N=C(N1)C(=O)O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations