Geometry & MOs

Info

ID:	246223
PubChem CID:	103050123
Reduced:	BrClFNH10C15 (1)
Stoich.:	ABCDE10F15 (1)
Weight, g/mol:	304.077869
ΔH_f, kcal/mol:	12.12
Dipole, Da:	4.02
IP(EA), eV:	-8.78(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-chloro-2-fluorophenyl)methyl]-3-ethylbenzimidazol-2-one

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)CN2C=CC3=C2C=CC(=C3)Br)F

DOS

IR

Vibrations