Geometry & MOs

Info

ID:

164275

PubChem CID:

74382689

Reduced:

O2N3C19H27 (1)

Stoich.:

A2B3C19D27 (1)

Weight, g/mol:

1070.629035

ΔHf, kcal/mol:

-51.7

Dipole, Da:

6.89

IP(EA), eV:

 -8.81(-0.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-[2-(1,18-dihydroxy-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-2,3,10,14,20-pentaoxo-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraen-12-yl)propyl]-2-methoxycyclohexyl]oxymethyl 2-morpholin-4-ylacetate

Drug info:

PubChemData

Smile

C1CC(C1)N2CCC(CC2)OC3=CC=C(C=C3)C4CC(=O)NNC4

DOS

IR

Vibrations