Geometry & MOs

Info

ID:	414313
PubChem CID:	135087269
Reduced:	N2O3C17H20 (1)
Stoich.:	A2B3C17D20 (1)
Weight, g/mol:	328.124549
ΔH_f, kcal/mol:	-97.37
Dipole, Da:	7.13
IP(EA), eV:	-8.69(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C2=C(C=C1)C(=CC(=N2)N3CCOC(C3)C(=O)O)C)C

DOS

IR

Vibrations