Geometry & MOs

Info

ID:	176379
PubChem CID:	76039662
Reduced:	BrF2O2H17C18 (1)
Stoich.:	AB2C2D17E18 (1)
Weight, g/mol:	402.0067
ΔH_f, kcal/mol:	-112.69
Dipole, Da:	2.27
IP(EA), eV:	-9.35(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-4-[1,2-difluoro-2-(2-phenylphenoxy)ethenoxy]benzene

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC=C1OC(=C(OC2=CC=C(C=C2)Br)F)F

DOS

IR

Vibrations