Geometry & MOs

Info

ID:	431404
PubChem CID:	135171479
Reduced:	NO2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	209.03559
ΔH_f, kcal/mol:	-54.36
Dipole, Da:	1.61
IP(EA), eV:	-7.98(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-3-ethyl-6H-pyrido[2,3-d]pyridazin-5-one

Drug info:

PubChemData

Smile

C/C(=C\C=C(/C=C)\OC1CCNCC1)/OC

DOS

IR

Vibrations