Geometry & MOs

Info

ID:	261223
PubChem CID:	103223316
Reduced:	ON4C13H24 (1)
Stoich.:	AB4C13D24 (1)
Weight, g/mol:	354.04915
ΔH_f, kcal/mol:	-30.62
Dipole, Da:	4.19
IP(EA), eV:	-9.02(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-aminoethyl(methyl)amino]-2-[(2-bromo-3-fluorophenyl)methyl]pyridazin-3-one

Drug info:

PubChemData

Smile

CCCCCCN1C(=O)C=C(C=N1)N(C)CCN

DOS

IR

Vibrations