Geometry & MOs

Info

ID:	208317
PubChem CID:	80517804
Reduced:	ON2C6H10 (2)
Stoich.:	AB2C6D10 (2)
Weight, g/mol:	247.106925
ΔH_f, kcal/mol:	-47.21
Dipole, Da:	4.16
IP(EA), eV:	-8.94(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-imidazol-1-ylpropylamino)pyridazine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCN(CC)CCCNC1=C(C=CN=N1)C(=O)O

DOS

IR

Vibrations