Geometry & MOs

Info

ID:	380699
PubChem CID:	134971226
Reduced:	FO2C8H8 (2)
Stoich.:	AB2C8D8 (2)
Weight, g/mol:	313.188923
ΔH_f, kcal/mol:	-234.78
Dipole, Da:	3.66
IP(EA), eV:	-9.79(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-3-amino-4-hydroxy-3-(hydroxymethyl)-5-[(E)-5-oxoundec-2-enyl]oxolan-2-one

Drug info:

PubChemData

Smile

CC1(O[C@@H]([C@H](O1)C2=CC=CC=C2)[C@@H]3C(C=CC(=O)O3)(F)F)C

DOS

IR

Vibrations