Geometry & MOs

Info

ID:

59695

PubChem CID:

24893957

Reduced:

F3N4O8C40H45 (1)

Stoich.:

A3B4C8D40E45 (1)

Weight, g/mol:

420.185629

ΔHf, kcal/mol:

-411.96

Dipole, Da:

9.0

IP(EA), eV:

 -8.65(-0.66)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(Z)-[(2S,3R,4R,5S,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-3-aminooxan-2-yl]oxyimino-(diethylamino)-oxidoazanium

Drug info:

PubChemData

Smile

CNCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F.CN(C)[C@H]1[C@@H]2C[C@@H]3CC4=C(C=CC(=C4C(=C3C(=O)[C@@]2(C(=O)/C(=C(/N)\O)/C1=O)O)O)O)N(C)C

DOS

IR

Vibrations