Geometry & MOs

Info

ID:	188948
PubChem CID:	77791564
Reduced:	N2O3F4C35H44 (1)
Stoich.:	A2B3C4D35E44 (1)
Weight, g/mol:	351.116546
ΔH_f, kcal/mol:	-313.74
Dipole, Da:	8.08
IP(EA), eV:	-9.07(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetyloxy-6-(3-acetyloxy-1,2-dihydroxypropyl)-5-amino-4-hydroxyoxane-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCCCCC(COC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)C(=O)OC(CCCCCC)C(F)(F)F)F

DOS

IR

Vibrations