Geometry & MOs

Info

ID:	249498
PubChem CID:	103090020
Reduced:	SN2O2C10H16 (1)
Stoich.:	AB2C2D10E16 (1)
Weight, g/mol:	250.025285
ΔH_f, kcal/mol:	-56.14
Dipole, Da:	3.77
IP(EA), eV:	-8.45(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chlorothiophen-2-yl)-5-methylsulfanylpentan-2-ol

Drug info:

PubChemData

Smile

COC1=NC=CN=C1C(CCCSC)O

DOS

IR

Vibrations