Geometry & MOs

Info

ID:	296068
PubChem CID:	117554203
Reduced:	FO2N3C13H14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	229.121512
ΔH_f, kcal/mol:	-90.54
Dipole, Da:	2.36
IP(EA), eV:	-9.06(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,5-dimethylphenyl)-5-methyl-1H-imidazole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=C(N1)C(C(=O)O)NC)C2=CC(=CC=C2)F

DOS

IR

Vibrations