Geometry & MOs

Info

ID:	83468
PubChem CID:	49857629
Reduced:	N3O4H25C26 (1)
Stoich.:	A3B4C25D26 (1)
Weight, g/mol:	456.216141
ΔH_f, kcal/mol:	-61.13
Dipole, Da:	5.57
IP(EA), eV:	-8.88(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-1-[6-(dimethylamino)pyridazin-3-yl]-4-[hydroxy-(4-methylphenyl)methylidene]-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)C2/C(=C(\C3=CC=C(C=C3)C)/O)/C(=O)C(=O)N2C4=NN=C(C=C4)C

DOS

IR

Vibrations