Geometry & MOs

Info

ID:	329540
PubChem CID:	126737902
Reduced:	N5O5C32H35 (1)
Stoich.:	A5B5C32D35 (1)
Weight, g/mol:	607.279469
ΔH_f, kcal/mol:	-113.74
Dipole, Da:	7.26
IP(EA), eV:	-8.45(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-[[3-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]carbamoylamino]phenyl]piperidin-3-yl]cyclopent-2-ene-1-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC(C1)NC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)C)OC4=C5C=C(C(=CC5=NC=C4)OC)OC

DOS

IR

Vibrations