Geometry & MOs

Info

ID:	246879
PubChem CID:	103065294
Reduced:	SN4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	195.083019
ΔH_f, kcal/mol:	36.5
Dipole, Da:	1.73
IP(EA), eV:	-8.42(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-(thiolan-3-yl)pyridine-3,5-diamine

Drug info:

PubChemData

Smile

CCCNC1=NC2=CC=CC=C2C(=N1)NC3CCSC3

DOS

IR

Vibrations