Geometry & MOs

Info

ID:	390025
PubChem CID:	134996673
Reduced:	SN2C12H12 (1)
Stoich.:	AB2C12D12 (1)
Weight, g/mol:	151.048407
ΔH_f, kcal/mol:	58.52
Dipole, Da:	0.6
IP(EA), eV:	-8.52(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=NC(=CN=C1SC)C2=CC=CC=C2

DOS

IR

Vibrations