Geometry & MOs

Info

ID:	439317
PubChem CID:	135229087
Reduced:	O4N7H19C27 (1)
Stoich.:	A4B7C19D27 (1)
Weight, g/mol:	524.155666
ΔH_f, kcal/mol:	20.29
Dipole, Da:	10.67
IP(EA), eV:	-9.01(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-methoxyphenyl)-5-oxo-1H-pyrazol-3-yl]-3-[8-[(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-7-yl)oxy]quinolin-5-yl]urea

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C(=CC(=O)N2)NC(=O)NC3=CC=C(C4=CC=CC=C43)OC5=C6C(=NC=C5)NC(=O)C=N6

DOS

IR

Vibrations