Geometry & MOs

Info

ID:	412971
PubChem CID:	135085909
Reduced:	SO3C19H32 (1)
Stoich.:	AB3C19D32 (1)
Weight, g/mol:	185.120449
ΔH_f, kcal/mol:	-161.44
Dipole, Da:	3.87
IP(EA), eV:	-10.26(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-1-prop-2-enylindole

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(C)OS(=O)(=O)C1=CC=CC=C1

DOS

IR

Vibrations