Geometry & MOs

Info

ID:	443064
PubChem CID:	135257593
Reduced:	SN2F5O6H29C30 (1)
Stoich.:	AB2C5D6E29F30 (1)
Weight, g/mol:	509.129535
ΔH_f, kcal/mol:	-409.09
Dipole, Da:	7.66
IP(EA), eV:	-9.33(-2.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-[methyl-(2,3,4,5,6-pentafluorophenyl)sulfonylamino]-4-phenylmethoxybutanoate

Drug info:

PubChemData

Smile

CN([C@H](CO)C(=O)N(CC1=CC=C(C=C1)C2CCCCC2)C3=CC=C(C=C3)C(=O)O)S(=O)(=O)C4=C(C(=C(C(=C4F)F)F)F)F

DOS

IR

Vibrations