Geometry & MOs

Info

ID:	8422
PubChem CID:	77615
Reduced:	SC8H10 (1)
Stoich.:	AB8C10 (1)
Weight, g/mol:	138.050321
ΔH_f, kcal/mol:	4.75
Dipole, Da:	1.5
IP(EA), eV:	-8.51(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethylbenzenethiol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)S

DOS

IR

Vibrations