Geometry & MOs

Info

ID:	137395
PubChem CID:	52203562
Reduced:	N2F3O4C16H21 (1)
Stoich.:	A2B3C4D16E21 (1)
Weight, g/mol:	362.145342
ΔH_f, kcal/mol:	-324.54
Dipole, Da:	4.25
IP(EA), eV:	-9.16(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxy-N-[(2R)-3-methyl-1-oxo-1-(2,2,2-trifluoroethylamino)butan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)NCC(F)(F)F)NC(=O)C1=CC(=CC(=C1)OC)OC

DOS

IR

Vibrations