Geometry & MOs

Info

ID:	295190
PubChem CID:	117520960
Reduced:	BrNO2F4C14H14 (1)
Stoich.:	ABC2D4E14F14 (1)
Weight, g/mol:	383.0144
ΔH_f, kcal/mol:	-271.04
Dipole, Da:	1.14
IP(EA), eV:	-9.13(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(6-bromo-2,2,3,3-tetrafluoro-1,4-benzodioxin-7-yl)methyl]piperidine

Drug info:

PubChemData

Smile

C1CC(CNC1)CC2=CC3=C(C=C2Br)OC(C(O3)(F)F)(F)F

DOS

IR

Vibrations