Geometry & MOs

Info

ID:	408033
PubChem CID:	135080788
Reduced:	BrOC13H17 (1)
Stoich.:	ABC13D17 (1)
Weight, g/mol:	236.086655
ΔH_f, kcal/mol:	-26.39
Dipole, Da:	2.4
IP(EA), eV:	-9.04(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)O/C(=C/CC(C)C)/Br

DOS

IR

Vibrations