Geometry & MOs

Info

ID:	259453
PubChem CID:	103165909
Reduced:	ClOC18H21 (1)
Stoich.:	ABC18D21 (1)
Weight, g/mol:	288.05136
ΔH_f, kcal/mol:	-28.84
Dipole, Da:	1.92
IP(EA), eV:	-8.95(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-bromo-2-cyclobutylethyl)naphthalene

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(C2=CC=CC3=CC=CC=C32)Cl

DOS

IR

Vibrations