Geometry & MOs

Info

ID:	2069
PubChem CID:	5723
Reduced:	F2N2O3H10C12 (1)
Stoich.:	A2B2C3D10E12 (1)
Weight, g/mol:	268.065949
ΔH_f, kcal/mol:	-158.55
Dipole, Da:	2.56
IP(EA), eV:	-9.14(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(difluoromethoxy)-3-methoxyphenyl]-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2=NNC(=O)C=C2)OC(F)F

DOS

IR

Vibrations