Geometry & MOs

Info

ID:	227659
PubChem CID:	87562177
Reduced:	SSnO2C10H20 (1)
Stoich.:	ABC2D10E20 (1)
Weight, g/mol:	204.118401
ΔH_f, kcal/mol:	-27.37
Dipole, Da:	2.33
IP(EA), eV:	-6.18(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sulfanyl 2-butylhexanoate

Drug info:

PubChemData

Smile

CCCCC(CCCC)C(=O)OS.[Sn]

DOS

IR

Vibrations