Geometry & MOs

Info

ID:	310701
PubChem CID:	126584407
Reduced:	NO4C21H25 (1)
Stoich.:	AB4C21D25 (1)
Weight, g/mol:	427.709
ΔH_f, kcal/mol:	-131.63
Dipole, Da:	2.8
IP(EA), eV:	-9.23(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

triiodo(methyl)-lambda4-sulfane

Drug info:

PubChemData

Smile

CC(C(=O)OCC1=CC=CC=C1)N(C)C(C)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations