Geometry & MOs

Info

ID:	344972
PubChem CID:	127268732
Reduced:	S2N3O4C16H25 (1)
Stoich.:	A2B3C4D16E25 (1)
Weight, g/mol:	378.1647
ΔH_f, kcal/mol:	-125.52
Dipole, Da:	3.32
IP(EA), eV:	-8.56(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(cyclohexylmethyl)piperazin-1-yl]sulfonylthiane 1,1-dioxide

Drug info:

PubChemData

Smile

CCN1CCCC(C1)NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)NC3CC3

DOS

IR

Vibrations