Geometry & MOs

Info

ID:	246860
PubChem CID:	103065176
Reduced:	SN4C8H12 (1)
Stoich.:	AB4C8D12 (1)
Weight, g/mol:	196.078268
ΔH_f, kcal/mol:	47.41
Dipole, Da:	4.72
IP(EA), eV:	-8.53(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(thiolan-3-yl)pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

C1CSCC1NC2=NN=C(C=C2)N

DOS

IR

Vibrations