Geometry & MOs

Info

ID:	198079
PubChem CID:	79044688
Reduced:	BrClFN2H13C16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	306.073532
ΔH_f, kcal/mol:	1.32
Dipole, Da:	4.95
IP(EA), eV:	-9.24(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-chloroethyl)-5-fluoro-1-(3-fluoro-5-methylphenyl)benzimidazole

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)N2C3=C(C=C(C=C3)Br)N=C2C(C)Cl

DOS

IR

Vibrations