Geometry & MOs

Info

ID:	419021
PubChem CID:	135107357
Reduced:	SN2O4C18H22 (1)
Stoich.:	AB2C4D18E22 (1)
Weight, g/mol:	373.134779
ΔH_f, kcal/mol:	-138.9
Dipole, Da:	3.64
IP(EA), eV:	-9.44(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,3-dimethoxyphenyl)-spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]-1'-ylmethanone

Drug info:

PubChemData

Smile

CS(=O)(=O)CCC(=O)N1C[C@H]([C@@H](C1)O)CC2=CC=NC3=CC=CC=C23

DOS

IR

Vibrations