Geometry & MOs

Info

ID:	394576
PubChem CID:	135023250
Reduced:	O7C10H14 (2)
Stoich.:	A7B10C14 (2)
Weight, g/mol:	491.015279
ΔH_f, kcal/mol:	-614.92
Dipole, Da:	5.15
IP(EA), eV:	-10.26(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4S)-3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C(=O)O)O)OC2C([C@H](C(C(O2)COC3C([C@H](C(C(O3)CO)O)O)O)O)O)O

DOS

IR

Vibrations