Geometry & MOs

Info

ID:	198341
PubChem CID:	79090075
Reduced:	BrNSF2O2C9H10 (1)
Stoich.:	ABCD2E2F9G10 (1)
Weight, g/mol:	260.043105
ΔH_f, kcal/mol:	-163.11
Dipole, Da:	3.79
IP(EA), eV:	-9.84(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyano-N-(2,2-difluoroethyl)-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Br)S(=O)(=O)NCC(F)F

DOS

IR

Vibrations