Geometry & MOs

Info

ID:	260478
PubChem CID:	103192942
Reduced:	BrNO2F3H11C14 (1)
Stoich.:	ABC2D3E11F14 (1)
Weight, g/mol:	368.03472
ΔH_f, kcal/mol:	-198.22
Dipole, Da:	3.24
IP(EA), eV:	-8.81(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-bromo-2-(trifluoromethoxy)anilino]-N-butan-2-ylacetamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)O)CNC2=C(C=C(C=C2)Br)OC(F)(F)F

DOS

IR

Vibrations