Geometry & MOs

Info

ID:	246859
PubChem CID:	103065172
Reduced:	N2O2S2C11H16 (1)
Stoich.:	A2B2C2D11E16 (1)
Weight, g/mol:	196.078268
ΔH_f, kcal/mol:	-68.89
Dipole, Da:	2.59
IP(EA), eV:	-8.69(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(thiolan-3-yl)pyridazine-3,6-diamine

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC(=N1)NC2CCSC2)C

DOS

IR

Vibrations