Geometry & MOs

Info

ID:	439214
PubChem CID:	135228980
Reduced:	INO3C6H14 (1)
Stoich.:	ABC3D6E14 (1)
Weight, g/mol:	573.071907
ΔH_f, kcal/mol:	-106.17
Dipole, Da:	2.49
IP(EA), eV:	-9.43(-2.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,4-dichlorophenyl)-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(COCCOCCOI)N

DOS

IR

Vibrations