Geometry & MOs

Info

ID:

181215

PubChem CID:

76715728

Reduced:

FSN6O8C36H51 (1)

Stoich.:

ABC6D8E36F51 (1)

Weight, g/mol:

472.23735

ΔHf, kcal/mol:

-352.2

Dipole, Da:

2.8

IP(EA), eV:

 -8.95(-0.53)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

14-(3-fluoro-5-methylanilino)-18-hydroxy-2,15-dioxo-16-azatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=CC=C2F)N=C1OC3CC4C(=O)CC5(CC5C=CCCCCCC(C(=O)N4C3)NC(=O)OC(C)(C)C)C(=O)NS(=O)(=O)N(C)C

DOS

IR

Vibrations