Geometry & MOs

Info

ID:	208294
PubChem CID:	80516052
Reduced:	FSN2O3C14H19 (1)
Stoich.:	ABC2D3E14F19 (1)
Weight, g/mol:	195.100777
ΔH_f, kcal/mol:	-168.29
Dipole, Da:	4.93
IP(EA), eV:	-9.65(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methylpropylamino)pyridazine-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1F)NC(=O)CC2CS(=O)(=O)CCN2

DOS

IR

Vibrations