Geometry & MOs

Info

ID:	379936
PubChem CID:	134964362
Reduced:	NSCl2O3C12H13 (1)
Stoich.:	ABC2D3E12F13 (1)
Weight, g/mol:	232.125201
ΔH_f, kcal/mol:	-130.18
Dipole, Da:	6.1
IP(EA), eV:	-10.26(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2-phenyl-1-prop-1-en-2-yl-1H-indene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CC([C@@H](C2=O)Cl)CCl

DOS

IR

Vibrations