Geometry & MOs

Info

ID:	197848
PubChem CID:	79006323
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	249.155121
ΔH_f, kcal/mol:	-10.93
Dipole, Da:	2.99
IP(EA), eV:	-9.09(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-1-(2-phenylsulfanylethyl)piperidine

Drug info:

PubChemData

Smile

CN(CCOCC1CC1)CCOC2=CC=CC=C2C#N

DOS

IR

Vibrations