Geometry & MOs

Info

ID:

215341

PubChem CID:

85084568

Reduced:

N3O10C45H77 (1)

Stoich.:

A3B10C45D77 (1)

Weight, g/mol:

820.37824

ΔHf, kcal/mol:

-555.71

Dipole, Da:

2.72

IP(EA), eV:

 -9.78(-0.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[(4-amino-4,5,6-trimethyloxan-2-yl)oxymethyl]-10-[5-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-4-(dimethylamino)-6-methyloxan-2-yl]-2-(2,3-dimethyloxiran-2-yl)-11-hydroxynaphtho[2,3-h]chromene-4,7,12-trione

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC(=O)NC(CC(=O)NC1C(C(C(C(O1)CO)O)O)NC(=O)CC(CCCCCCCCCCC)O)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations