Geometry & MOs

Info

ID:

17110

PubChem CID:

484454

Reduced:

F2N2O6H14C21 (1)

Stoich.:

A2B2C6D14E21 (1)

Weight, g/mol:

428.081993

ΔHf, kcal/mol:

-269.54

Dipole, Da:

4.95

IP(EA), eV:

 -9.51(-2.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5S)-5-ethyl-19,19-difluoro-5-hydroxy-7,18,20-trioxa-11,24-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,21]tetracosa-1(13),2,4(9),14,16,21,23-heptaene-6,10-dione

Drug info:

PubChemData

Smile

CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=C6C(=CC5=C4)OC(O6)(F)F)O

DOS

IR

Vibrations