Geometry & MOs

Info

ID:	300257
PubChem CID:	121270003
Reduced:	F2O2N3H11C15 (1)
Stoich.:	A2B2C3D11E15 (1)
Weight, g/mol:	333.092498
ΔH_f, kcal/mol:	-23.02
Dipole, Da:	10.08
IP(EA), eV:	-9.73(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-difluoro-1-[(4-methoxyphenyl)methyl]-2-methyl-4-nitrobenzimidazole

Drug info:

PubChemData

Smile

CC1=NC2=C(C(=C(C=C2N1CC3=CC=CC=C3)F)F)[N+](=O)[O-]

DOS

IR

Vibrations