Geometry & MOs

Info

ID:

11072

PubChem CID:

110751

Reduced:

NO7C28H47 (1)

Stoich.:

AB7C28D47 (1)

Weight, g/mol:

509.335253

ΔHf, kcal/mol:

-322.71

Dipole, Da:

3.85

IP(EA), eV:

 -8.81(0.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3R,5R,6S,7R,9R,13R,14R)-6-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-3,5,7,9,13-pentamethyl-1-oxacyclotetradec-11-ene-2,4,10-trione

Drug info:

PubChemData

Smile

CC[C@@H]1[C@@H](C=CC(=O)[C@@H](C[C@H]([C@@H]([C@H](C(=O)[C@H](C(=O)O1)C)C)OC2C(C(CC(O2)C)N(C)C)O)C)C)C

DOS

IR

Vibrations