Geometry & MOs

Info

ID:

396952

PubChem CID:

135029502

Reduced:

OH18C26 (1)

Stoich.:

AB18C26 (1)

Weight, g/mol:

522.345758

ΔHf, kcal/mol:

54.67

Dipole, Da:

3.69

IP(EA), eV:

 -9.2(-0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,2R,6R,7E,9E,11E,18R,19S,21S,26R)-2-hydroxy-20,34-dioxa-14,29-diazahexacyclo[24.6.2.218,21.01,6.014,19.029,33]hexatriaconta-3,7,9,11-tetraen-28-one

Drug info:

PubChemData

Smile

CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3C4=CC=CC=C4C5=CC=CC=C52

DOS

IR

Vibrations