Geometry & MOs

Info

ID:	130210
PubChem CID:	51075270
Reduced:	OSF2N2C12H12 (1)
Stoich.:	ABC2D2E12F12 (1)
Weight, g/mol:	314.072513
ΔH_f, kcal/mol:	-94.64
Dipole, Da:	2.23
IP(EA), eV:	-9.76(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylsulfonylbenzimidazol-1-yl)-1-phenylethanone

Drug info:

PubChemData

Smile

CN(CCC#N)C(=O)C1=CC=C(C=C1)SC(F)F

DOS

IR

Vibrations