Geometry & MOs

Info

ID:	424403
PubChem CID:	135122566
Reduced:	ClO3N5C25H30 (1)
Stoich.:	AB3C5D25E30 (1)
Weight, g/mol:	483.203717
ΔH_f, kcal/mol:	-83.14
Dipole, Da:	4.02
IP(EA), eV:	-8.22(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-[[5-chloro-2-(3,5-dimethylpiperidin-1-yl)pyridin-4-yl]amino]-1-methyl-2-oxoquinolin-3-yl]oxy-N-methylacetamide

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](CN(C1)C2=NC=C(C(=C2)NC3=CC4=C(C=C3)N(C(=O)C(=C4)OCC(=O)NC)C)Cl)C

DOS

IR

Vibrations