Geometry & MOs

Info

ID:	218957
PubChem CID:	85090251
Reduced:	PdN2F5C14H21 (1)
Stoich.:	AB2C5D14E21 (1)
Weight, g/mol:	281.98557
ΔH_f, kcal/mol:	-132.98
Dipole, Da:	2.11
IP(EA), eV:	-7.15(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-4-[4-(difluoromethyl)phenyl]benzene

Drug info:

PubChemData

Smile

CN(C)CCN(C)C.C1=CC(=CC=[C-]1)C(F)(F)F.[CH-](F)F.[Pd+2]

DOS

IR

Vibrations