Geometry & MOs

Info

ID:	304205
PubChem CID:	124498770
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	248.152478
ΔH_f, kcal/mol:	-43.63
Dipole, Da:	2.55
IP(EA), eV:	-8.53(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-2-(6-methoxy-4-methylpyridin-3-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCCCN1CCCC[C@H]1C2=CN=C(C=C2C)OC

DOS

IR

Vibrations