Geometry & MOs

Info

ID:	417754
PubChem CID:	135102644
Reduced:	SN2O2C23H26 (1)
Stoich.:	AB2C2D23E26 (1)
Weight, g/mol:	324.183778
ΔH_f, kcal/mol:	-37.52
Dipole, Da:	5.07
IP(EA), eV:	-8.69(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-1'-(pyridin-2-ylmethyl)spiro[3,4-dihydroisochromene-1,4'-piperidine]

Drug info:

PubChemData

Smile

CC1=CC2(CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=CC=CC=N4)OCC1

DOS

IR

Vibrations