Geometry & MOs

Info

ID:	410928
PubChem CID:	135083729
Reduced:	NOSC11H15 (1)
Stoich.:	ABCD11E15 (1)
Weight, g/mol:	219.081477
ΔH_f, kcal/mol:	3.6
Dipole, Da:	5.83
IP(EA), eV:	-8.13(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-1,7-dimethyl-2-prop-1-enylindole

Drug info:

PubChemData

Smile

CC(C)(C)[S@@](=O)/N=C\C1=CC=CC=C1

DOS

IR

Vibrations