Geometry & MOs

Info

ID:	327935
PubChem CID:	126691426
Reduced:	NF3O5C22H34 (1)
Stoich.:	AB3C5D22E34 (1)
Weight, g/mol:	447.223258
ΔH_f, kcal/mol:	-432.54
Dipole, Da:	6.55
IP(EA), eV:	-10.58(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2R,3R)-2-(1-cyclopropylethenyl)-6,6,6-trifluoro-3-[(4S)-2-oxo-4-propan-2-yl-1,3-oxazolidine-3-carbonyl]hexanoate

Drug info:

PubChemData

Smile

CC(C)[C@H]1COC(=O)N1C(=O)[C@H](CCC(F)(F)F)[C@@H](CCC2CC2)C(=O)OC(C)(C)C

DOS

IR

Vibrations