Geometry & MOs

Info

ID:	395442
PubChem CID:	135025487
Reduced:	NOSH17C21 (1)
Stoich.:	ABCD17E21 (1)
Weight, g/mol:	371.111063
ΔH_f, kcal/mol:	83.93
Dipole, Da:	1.5
IP(EA), eV:	-8.4(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(cyclohexylsulfanylmethyl)-1-hydroxy-2-phenylindole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2O)CSC4=CC=CC=C4

DOS

IR

Vibrations