Geometry & MOs

Info

ID:	439144
PubChem CID:	135228909
Reduced:	NOC14H17 (2)
Stoich.:	ABC14D17 (2)
Weight, g/mol:	535.160417
ΔH_f, kcal/mol:	30.33
Dipole, Da:	6.1
IP(EA), eV:	-8.52(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-methoxyphenyl)-5-oxo-1H-pyrazol-3-yl]-3-[4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]naphthalen-1-yl]urea

Drug info:

PubChemData

Smile

C/C=C\1/C2=CC=CC=C2C(N1C)CC(C3CCC(=CCOCC4=CC=CC=C4)CC3)N=O

DOS

IR

Vibrations