Geometry & MOs

Info

ID:	206589
PubChem CID:	80269672
Reduced:	BrF3C13H14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	320.03875
ΔH_f, kcal/mol:	-139.56
Dipole, Da:	2.07
IP(EA), eV:	-10.1(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[bromo-(1-ethylcyclopentyl)methyl]-1,3,5-trifluorobenzene

Drug info:

PubChemData

Smile

CC1(CCCC1)C(C2=C(C=C(C=C2F)F)F)Br

DOS

IR

Vibrations