Geometry & MOs

Info

ID:	204857
PubChem CID:	80021916
Reduced:	NOSC14H21 (1)
Stoich.:	ABCD14E21 (1)
Weight, g/mol:	156.035734
ΔH_f, kcal/mol:	-35.7
Dipole, Da:	9.53
IP(EA), eV:	-8.8(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-sulfanylethyl)pyridazin-3-one

Drug info:

PubChemData

Smile

C1CCCC(CC1)(CN2C=CC(=O)C=C2)CS

DOS

IR

Vibrations