Geometry & MOs

Info

ID:	414321
PubChem CID:	135087277
Reduced:	ON2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	406.236876
ΔH_f, kcal/mol:	-73.25
Dipole, Da:	3.6
IP(EA), eV:	-9.27(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8-dimethoxy-4-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)quinolin-2-amine

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)N2CCC(CC2)C(=O)NCCC3=NC=CN=C3

DOS

IR

Vibrations