Geometry & MOs

Info

ID:	439220
PubChem CID:	135228987
Reduced:	N2O3C13H24 (1)
Stoich.:	A2B3C13D24 (1)
Weight, g/mol:	555.082472
ΔH_f, kcal/mol:	-162.81
Dipole, Da:	2.72
IP(EA), eV:	-9.53(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2,3-dichloro-4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]phenyl]-3-[2-(4-methoxyphenyl)-5-oxo-1H-pyrazol-3-yl]urea

Drug info:

PubChemData

Smile

C1CN(CCC1C(N)O)C(=O)CC2CCOCC2

DOS

IR

Vibrations