Geometry & MOs

Info

ID:	287312
PubChem CID:	104234358
Reduced:	BrNOF2C16H16 (1)
Stoich.:	ABCD2E16F16 (1)
Weight, g/mol:	296.190006
ΔH_f, kcal/mol:	-84.61
Dipole, Da:	4.43
IP(EA), eV:	-9.26(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-fluoro-4-[1-(methylamino)ethyl]phenoxy]-N-(2-methylbutan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCC2=C(C=C(C=C2)Br)F)F)NC

DOS

IR

Vibrations