Geometry & MOs

Info

ID:	269853
PubChem CID:	103619426
Reduced:	F2N2O2H8C13 (1)
Stoich.:	A2B2C2D8E13 (1)
Weight, g/mol:	325.96665
ΔH_f, kcal/mol:	-94.76
Dipole, Da:	5.97
IP(EA), eV:	-8.1(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromo-4-fluorophenyl)-5,6-difluoro-1H-benzimidazole

Drug info:

PubChemData

Smile

C1=CC(=O)C(=CC1=C2NC3=CC(=C(C=C3N2)F)F)O

DOS

IR

Vibrations