Geometry & MOs

Info

ID:	415348
PubChem CID:	135088342
Reduced:	ON2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	338.108899
ΔH_f, kcal/mol:	-48.48
Dipole, Da:	2.21
IP(EA), eV:	-8.45(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC[C@]1(CCC[C@H]2[C@@H]1CN(C2)CC3=CC=CC(=N3)C)O

DOS

IR

Vibrations