Geometry & MOs

Info

ID:	244903
PubChem CID:	99431560
Reduced:	N2F3O3C19H19 (1)
Stoich.:	A2B3C3D19E19 (1)
Weight, g/mol:	380.134777
ΔH_f, kcal/mol:	-246.5
Dipole, Da:	6.63
IP(EA), eV:	-9.9(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-oxo-2-[[(3S)-4,4,4-trifluoro-3-hydroxy-3-phenylbutyl]amino]ethyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)NCC(=O)NCC[C@@](C2=CC=CC=C2)(C(F)(F)F)O

DOS

IR

Vibrations