Geometry & MOs

Info

ID:	208315
PubChem CID:	80517435
Reduced:	FN2O3H7C11 (1)
Stoich.:	AB2C3D7E11 (1)
Weight, g/mol:	279.081933
ΔH_f, kcal/mol:	-80.11
Dipole, Da:	2.36
IP(EA), eV:	-10.27(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3,5-difluorophenyl)ethylamino]pyridazine-4-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)OC2=C(C=CN=N2)C(=O)O

DOS

IR

Vibrations