Geometry & MOs

Info

ID:	23351
PubChem CID:	603164
Reduced:	BrNO2F4H12C16 (1)
Stoich.:	ABC2D4E12F16 (1)
Weight, g/mol:	404.99875
ΔH_f, kcal/mol:	-232.82
Dipole, Da:	2.15
IP(EA), eV:	-8.88(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[2-(2,2,3,3-tetrafluoropropoxy)phenyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NC2=CC=CC=C2OCC(C(F)F)(F)F)Br

DOS

IR

Vibrations