Geometry & MOs

Info

ID:	51233
PubChem CID:	12013873
Reduced:	OSC10H12 (1)
Stoich.:	ABC10D12 (1)
Weight, g/mol:	245.172552
ΔH_f, kcal/mol:	1.65
Dipole, Da:	2.87
IP(EA), eV:	-8.8(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2CS2

DOS

IR

Vibrations