Geometry & MOs

Info

ID:	304193
PubChem CID:	124498515
Reduced:	NOC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	310.168128
ΔH_f, kcal/mol:	-61.6
Dipole, Da:	4.42
IP(EA), eV:	-9.19(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-2-(6-methoxy-5-methylpyridin-3-yl)piperidin-1-yl]-phenylmethanone

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1OC)[C@H]2CCCN2C=O

DOS

IR

Vibrations