Geometry & MOs

Info

ID:	24408
PubChem CID:	609985
Reduced:	ClNC18H18 (1)
Stoich.:	ABC18D18 (1)
Weight, g/mol:	283.112777
ΔH_f, kcal/mol:	32.4
Dipole, Da:	4.0
IP(EA), eV:	-8.26(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorobutyl)-3-phenyl-1H-indole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(NC3=CC=CC=C32)CCCCCl

DOS

IR

Vibrations