Geometry & MOs

Info

ID:	191662
PubChem CID:	78174386
Reduced:	BrON4C13H17 (1)
Stoich.:	ABC4D13E17 (1)
Weight, g/mol:	308.067618
ΔH_f, kcal/mol:	25.64
Dipole, Da:	6.83
IP(EA), eV:	-9.25(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5-[2-[(3,4-dimethoxyphenyl)methylidene]hydrazinyl]-4H-pyridazin-3-one

Drug info:

PubChemData

Smile

CCC(=NNC1CNNC(=O)C1Br)C2=CC=CC=C2

DOS

IR

Vibrations