Geometry & MOs

Info

ID:	84343
PubChem CID:	49865935
Reduced:	ON2C21H22 (1)
Stoich.:	AB2C21D22 (1)
Weight, g/mol:	246.111208
ΔH_f, kcal/mol:	18.48
Dipole, Da:	5.53
IP(EA), eV:	-8.8(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexylsulfinylsulfanylcyclohexane

Drug info:

PubChemData

Smile

C1CC(CNC1)(CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)NC=C4

DOS

IR

Vibrations