Geometry & MOs

Info

ID:	388264
PubChem CID:	134988665
Reduced:	NOCl2H3C4 (1)
Stoich.:	ABC2D3E4 (1)
Weight, g/mol:	250.102751
ΔH_f, kcal/mol:	-24.55
Dipole, Da:	1.07
IP(EA), eV:	-10.06(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-2-(2-phenylethyl)-3,6-dihydro-2H-thiopyran-4-ol

Drug info:

PubChemData

Smile

C(/C=C(/N=C=O)\Cl)Cl

DOS

IR

Vibrations