Geometry & MOs

Info

ID:	361164
PubChem CID:	127302108
Reduced:	ClN2O3C20H25 (1)
Stoich.:	AB2C3D20E25 (1)
Weight, g/mol:	381.241627
ΔH_f, kcal/mol:	-100.03
Dipole, Da:	2.35
IP(EA), eV:	-8.85(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-N-[(4-piperidin-1-yloxan-4-yl)methyl]quinoline-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2(CCOCC2)CNC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

DOS

IR

Vibrations