Geometry & MOs

Info

ID:	46909
PubChem CID:	10528297
Reduced:	S9H12C14 (1)
Stoich.:	A9B12C14 (1)
Weight, g/mol:	468.970018
ΔH_f, kcal/mol:	96.06
Dipole, Da:	2.69
IP(EA), eV:	-7.76(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-sulfamoylphenyl)methyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate

Drug info:

PubChemData

Smile

C1CSCCC1=C2SC3=C(S2)SC(=C4SC5=C(S4)SCCS5)S3

DOS

IR

Vibrations