Geometry & MOs

Info

ID:	314270
PubChem CID:	126621117
Reduced:	SC14H22 (1)
Stoich.:	AB14C22 (1)
Weight, g/mol:	286.269422
ΔH_f, kcal/mol:	-7.05
Dipole, Da:	1.15
IP(EA), eV:	-8.74(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hexyl-2,2-dimethyldecane-3-thiol

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=CS1)C(=C)C(C)(C)C

DOS

IR

Vibrations