Geometry & MOs

Info

ID:	369500
PubChem CID:	127334242
Reduced:	ClON2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	238.087291
ΔH_f, kcal/mol:	-36.86
Dipole, Da:	4.62
IP(EA), eV:	-9.36(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-chloropyridin-2-yl)-(4-methylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C(=O)C2=NC=C(C=C2)Cl)C

DOS

IR

Vibrations