Geometry & MOs

Info

ID:	302957
PubChem CID:	124489016
Reduced:	ClC14H19 (1)
Stoich.:	AB14C19 (1)
Weight, g/mol:	222.117528
ΔH_f, kcal/mol:	-22.3
Dipole, Da:	2.48
IP(EA), eV:	-9.1(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(4-chlorobutyl)-1,2,3,4-tetrahydronaphthalene

Drug info:

PubChemData

Smile

C1C[C@@H](C2=CC=CC=C2C1)CCCCCl

DOS

IR

Vibrations