Geometry & MOs

Info

ID:	208311
PubChem CID:	80516887
Reduced:	O2N4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	237.147727
ΔH_f, kcal/mol:	-46.74
Dipole, Da:	2.88
IP(EA), eV:	-9.05(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)CN(CCN(C)C)C1=C(C=CN=N1)C(=O)O

DOS

IR

Vibrations