Geometry & MOs

Info

ID:	248527
PubChem CID:	103082385
Reduced:	BrNF2O3C12H14 (1)
Stoich.:	ABC2D3E12F14 (1)
Weight, g/mol:	261.097663
ΔH_f, kcal/mol:	-202.21
Dipole, Da:	2.88
IP(EA), eV:	-9.35(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,2-difluoroethoxy)ethyl]-4-fluoro-2-methylbenzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)NCCOCC(F)F)Br

DOS

IR

Vibrations