Geometry & MOs

Info

ID:	208308
PubChem CID:	80516884
Reduced:	O2N4C13H14 (1)
Stoich.:	A2B4C13D14 (1)
Weight, g/mol:	235.056861
ΔH_f, kcal/mol:	0.08
Dipole, Da:	3.64
IP(EA), eV:	-9.43(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[methyl(2,2,2-trifluoroethyl)amino]pyridazine-4-carboxylic acid

Drug info:

PubChemData

Smile

CN(CCC1=CC=NC=C1)C2=C(C=CN=N2)C(=O)O

DOS

IR

Vibrations