Geometry & MOs

Info

ID:	21242
PubChem CID:	587765
Reduced:	SN2C6H8 (1)
Stoich.:	AB2C6D8 (1)
Weight, g/mol:	140.040819
ΔH_f, kcal/mol:	50.56
Dipole, Da:	3.67
IP(EA), eV:	-8.72(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-prop-2-enylimidazole-2-thiol

Drug info:

PubChemData

Smile

C=CCN1C=CN=C1S

DOS

IR

Vibrations