Geometry & MOs

Info

ID:	202812
PubChem CID:	79730953
Reduced:	BrF2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	389.92533
ΔH_f, kcal/mol:	-109.14
Dipole, Da:	2.4
IP(EA), eV:	-9.64(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[bromo-(4-bromo-2-methylphenyl)methyl]-2,4-difluoro-5-methylbenzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations