Geometry & MOs

Info

ID:	321371
PubChem CID:	126665903
Reduced:	O2H3N3C5 (1)
Stoich.:	A2B3C3D5 (1)
Weight, g/mol:	307.052383
ΔH_f, kcal/mol:	25.39
Dipole, Da:	6.56
IP(EA), eV:	-10.34(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-chloro-2-fluorophenyl)methyl]-3,7-dimethyl-[1,2]oxazolo[4,5-d]pyridazin-4-one

Drug info:

PubChemData

Smile

C1=CN=NC2=C1NOC2=O

DOS

IR

Vibrations