Geometry & MOs

Info

ID:	413828
PubChem CID:	135086778
Reduced:	OC4H4 (4)
Stoich.:	AB4C4 (4)
Weight, g/mol:	300.07005
ΔH_f, kcal/mol:	-85.68
Dipole, Da:	1.75
IP(EA), eV:	-9.36(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-12-bromo-1,1,1-trifluorododec-4-ene

Drug info:

PubChemData

Smile

C=CC(COCC1=CC=CC=C1)OC(=O)C2=CC=CO2

DOS

IR

Vibrations