Geometry & MOs

Info

ID:	24515
PubChem CID:	610700
Reduced:	NSCl2O2H5C8 (1)
Stoich.:	ABC2D2E5F8 (1)
Weight, g/mol:	248.941805
ΔH_f, kcal/mol:	-32.68
Dipole, Da:	4.67
IP(EA), eV:	-10.15(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dichlorophenyl)sulfonylacetonitrile

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)S(=O)(=O)CC#N)Cl

DOS

IR

Vibrations