Geometry & MOs

Info

ID:	134916
PubChem CID:	51783197
Reduced:	SN2F3O4H25C26 (1)
Stoich.:	AB2C3D4E25F26 (1)
Weight, g/mol:	354.194343
ΔH_f, kcal/mol:	-260.03
Dipole, Da:	8.89
IP(EA), eV:	-9.65(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-tert-butyl-2-(2-hydroxyphenyl)-2-[methyl-(2-phenylacetyl)amino]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)[C@H](C2=CC=C(C=C2)C(F)(F)F)N(C)C(=O)CC3=CC=CC=C3

DOS

IR

Vibrations