Geometry & MOs

Info

ID:	426835
PubChem CID:	135154097
Reduced:	O3N4C19H24 (1)
Stoich.:	A3B4C19D24 (1)
Weight, g/mol:	219.980633
ΔH_f, kcal/mol:	-76.9
Dipole, Da:	4.66
IP(EA), eV:	-8.71(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5,6-dichloropyridazine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1N2CCC(CC2)OC3=CN=C(C=C3)OC)C)C(=O)N

DOS

IR

Vibrations