Geometry & MOs

Info

ID:	49065
PubChem CID:	11528671
Reduced:	OSC13H18 (1)
Stoich.:	ABC13D18 (1)
Weight, g/mol:	222.00441
ΔH_f, kcal/mol:	-28.93
Dipole, Da:	0.94
IP(EA), eV:	-8.63(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-4-(cyclopenten-1-yl)benzene

Drug info:

PubChemData

Smile

CC(CC(CC=C)O)SC1=CC=CC=C1

DOS

IR

Vibrations