Geometry & MOs

Info

ID:	369499
PubChem CID:	127334241
Reduced:	ClON2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	252.102941
ΔH_f, kcal/mol:	-30.34
Dipole, Da:	4.54
IP(EA), eV:	-9.4(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloropyridin-2-yl)-(3,5-dimethylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(=O)C2=NC=C(C=C2)Cl

DOS

IR

Vibrations