Geometry & MOs

Info

ID:	229660
PubChem CID:	87568347
Reduced:	ClO4S5N8C23H23 (1)
Stoich.:	AB4C5D8E23F23 (1)
Weight, g/mol:	698.050163
ΔH_f, kcal/mol:	5.1
Dipole, Da:	9.95
IP(EA), eV:	-9.01(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,3,3,4,4,5,5-octafluoro-5-sulfonatopentanoate;(2-phenylphenyl)sulfanium

Drug info:

PubChemData

Smile

CC(C)(C)C1=CSC(=N1)NC2=NC=C(C=C2)S(=O)(=O)NC3=NC=CS3.C1=CC(=NC=C1S(=O)(=O)NC2=NC=CS2)Cl

DOS

IR

Vibrations