Geometry & MOs

Info

ID:	439282
PubChem CID:	135229049
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	536.155666
ΔH_f, kcal/mol:	13.37
Dipole, Da:	7.41
IP(EA), eV:	-8.35(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(6-methoxypyridin-3-yl)-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

CCCC[C@@H](CCO)NC1=NC(=NC=C1OCC2=NN(C3=CC=CC=C32)C)C=C

DOS

IR

Vibrations