Geometry & MOs

Info

ID:	165945
PubChem CID:	74617755
Reduced:	N3O5C27H29 (1)
Stoich.:	A3B5C27D29 (1)
Weight, g/mol:	360.14337
ΔH_f, kcal/mol:	-125.84
Dipole, Da:	5.48
IP(EA), eV:	-8.71(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-butoxy-3-methoxybenzoyl)-6-oxo-3H-pyridazine-3-carbohydrazide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2CCCN(C2)C(=O)C3=CC=CC4=CC=CC=C43)OC

DOS

IR

Vibrations