Geometry & MOs

Info

ID:	202811
PubChem CID:	79730952
Reduced:	BrF2C17H17 (1)
Stoich.:	AB2C17D17 (1)
Weight, g/mol:	290.04817
ΔH_f, kcal/mol:	-71.01
Dipole, Da:	2.18
IP(EA), eV:	-9.55(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-bromo-2-ethylbutyl)-2,4-difluoro-5-methylbenzene

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1)C(C2=C(C=C(C(=C2)C)F)F)Br

DOS

IR

Vibrations