Geometry & MOs

Info

ID:	291828
PubChem CID:	113584955
Reduced:	ClO3N4C10H11 (1)
Stoich.:	AB3C4D10E11 (1)
Weight, g/mol:	303.05824
ΔH_f, kcal/mol:	-30.58
Dipole, Da:	7.08
IP(EA), eV:	-9.18(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-ethyl-5-[(3-hydroxy-2,2-dimethylpropyl)amino]pyridazin-3-one

Drug info:

PubChemData

Smile

C1=CON=C1CNC2=C(C(=O)N(N=C2)CCO)Cl

DOS

IR

Vibrations