Geometry & MOs

Info

ID:	438257
PubChem CID:	135227985
Reduced:	FOC15H15 (1)
Stoich.:	ABC15D15 (1)
Weight, g/mol:	408.206245
ΔH_f, kcal/mol:	-14.05
Dipole, Da:	1.53
IP(EA), eV:	-9.29(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3,5-dimethyltriazol-4-yl)-1-[2-(4-methylphenyl)-1-pyridin-2-ylethyl]benzimidazole

Drug info:

PubChemData

Smile

C/1C/C(=C(\C=C/C=C1)/F)/C(C2=CC=CC=C2)O

DOS

IR

Vibrations