Geometry & MOs

Info

ID:	50761
PubChem CID:	12013349
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	264.068589
ΔH_f, kcal/mol:	-67.09
Dipole, Da:	5.66
IP(EA), eV:	-9.75(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dimethyl-2-(1,1,2,2,2-pentafluoroethyl)-1H-benzimidazole

Drug info:

PubChemData

Smile

C[C@H]1COC(=O)N1CC2=CC=CC=C2

DOS

IR

Vibrations