Geometry & MOs

Info

ID:	208297
PubChem CID:	80516454
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	209.116427
ΔH_f, kcal/mol:	-72.33
Dipole, Da:	1.39
IP(EA), eV:	-9.14(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(pentan-3-ylamino)pyridazine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC1=C(N=NC(=C1C(=O)O)NC2CCCC2)CC

DOS

IR

Vibrations