Geometry & MOs

Info

ID:	261212
PubChem CID:	103222642
Reduced:	ClISN2O2H6C10 (1)
Stoich.:	ABCD2E2F6G10 (1)
Weight, g/mol:	279.077454
ΔH_f, kcal/mol:	-19.59
Dipole, Da:	4.0
IP(EA), eV:	-9.27(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-aminoethoxy)-2-[(2-chlorophenyl)methyl]pyridazin-3-one

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C2=NC(=C(S2)N)C(=O)O)Cl)I

DOS

IR

Vibrations