Geometry & MOs

Info

ID:	434048
PubChem CID:	135174201
Reduced:	SO2C8H12 (1)
Stoich.:	AB2C8D12 (1)
Weight, g/mol:	196.128572
ΔH_f, kcal/mol:	-90.63
Dipole, Da:	2.51
IP(EA), eV:	-8.93(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexylidene-6-methylthiane

Drug info:

PubChemData

Smile

CCC(=O)C1CCSCC1=O

DOS

IR

Vibrations