Geometry & MOs

Info

ID:	28583
PubChem CID:	828457
Reduced:	ON2H14C18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	279.173548
ΔH_f, kcal/mol:	57.2
Dipole, Da:	5.6
IP(EA), eV:	-9.02(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-2-(4-methylpiperidin-1-yl)quinoline-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=C1)C=C(C(=N2)OC3=CC=CC=C3)C#N)C

DOS

IR

Vibrations