Geometry & MOs

Info

ID:

223920

PubChem CID:

85335782

Reduced:

F2O4N5C42H53 (1)

Stoich.:

A2B4C5D42E53 (1)

Weight, g/mol:

731.298885

ΔHf, kcal/mol:

-203.55

Dipole, Da:

8.82

IP(EA), eV:

 -8.84(-1.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

18-[2-(2-acetamido-1,3-thiazol-4-yl)-7-methoxyquinolin-4-yl]oxy-14-cyclopentyloxy-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid

Drug info:

PubChemData

Smile

CCCC#CC1=CC=CC(=C1)CNCOC(=O)N2CCC(C2(CCC)NC(=O)C3=CC(=CC(=C3)C)C(=O)N(CCC)CCC)(C4=CC(=CC(=C4)F)F)N

DOS

IR

Vibrations