Geometry & MOs

Info

ID:	337138
PubChem CID:	127256703
Reduced:	SO3C6H6 (1)
Stoich.:	AB3C6D6 (1)
Weight, g/mol:	184.055801
ΔH_f, kcal/mol:	-3.56
Dipole, Da:	4.52
IP(EA), eV:	-9.21(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2H-thiopyran-4-yl)acetate

Drug info:

PubChemData

Smile

C1C=CSC(C1=O)C2OO2

DOS

IR

Vibrations