Geometry & MOs

Info

ID:	260855
PubChem CID:	103207035
Reduced:	BrNOF3C10H11 (1)
Stoich.:	ABCD3E10F11 (1)
Weight, g/mol:	274.092912
ΔH_f, kcal/mol:	-176.21
Dipole, Da:	3.24
IP(EA), eV:	-9.62(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-amino-2-(2,2,2-trifluoroethoxy)ethyl]-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(COCC(F)(F)F)N)Br

DOS

IR

Vibrations