Geometry & MOs

Info

ID:	60990
PubChem CID:	26703948
Reduced:	FO5N6C24H25 (1)
Stoich.:	AB5C6D24E25 (1)
Weight, g/mol:	426.133948
ΔH_f, kcal/mol:	-141.71
Dipole, Da:	8.17
IP(EA), eV:	-9.24(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3,5-dimethoxybenzoyl)-1-(2-fluorophenyl)-6-methyl-4-oxopyridazine-3-carbohydrazide

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)CCC3=NC(=NO3)C4=CC=C(C=C4)F)N

DOS

IR

Vibrations