Geometry & MOs

Info

ID:	261115
PubChem CID:	103218306
Reduced:	ClO2N3H12C13 (1)
Stoich.:	AB2C3D12E13 (1)
Weight, g/mol:	223.168462
ΔH_f, kcal/mol:	-27.61
Dipole, Da:	3.17
IP(EA), eV:	-8.71(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-heptyl-5-(methylamino)pyridazin-3-one

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2CN3C(=O)C=C(C=N3)N)Cl

DOS

IR

Vibrations