Geometry & MOs

Info

ID:	373184
PubChem CID:	131311225
Reduced:	NO2C5H9 (1)
Stoich.:	AB2C5D9 (1)
Weight, g/mol:	282.98196
ΔH_f, kcal/mol:	-71.31
Dipole, Da:	1.93
IP(EA), eV:	-9.66(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(3-bromo-5-methoxyphenyl)-2,2,2-trifluoroethanamine

Drug info:

PubChemData

Smile

COC(=O)C1C[C@H]1N

DOS

IR

Vibrations