Geometry & MOs

Info

ID:	415349
PubChem CID:	135088343
Reduced:	SN2O2H18C19 (1)
Stoich.:	AB2C2D18E19 (1)
Weight, g/mol:	340.251464
ΔH_f, kcal/mol:	-6.83
Dipole, Da:	7.12
IP(EA), eV:	-9.36(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-9-[1-(4-methylphenyl)piperidin-4-yl]-1-oxa-9-azaspiro[5.5]undec-4-ene

Drug info:

PubChemData

Smile

C1COC2(CCN(CC2)C(=O)C3=CC=CC(=C3)C#N)C4=C1SC=C4

DOS

IR

Vibrations