Geometry & MOs

Info

ID:

82728

PubChem CID:

49856403

Reduced:

ClN5O6C35H44 (1)

Stoich.:

AB5C6D35E44 (1)

Weight, g/mol:

666.293261

ΔHf, kcal/mol:

-208.42

Dipole, Da:

11.06

IP(EA), eV:

 -8.6(-1.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[2-[2-[[2-[2-[(7-chloroquinolin-4-yl)amino]ethyl-ethylamino]acetyl]amino]ethoxy]ethoxy]ethyl]-2-[7-(dimethylamino)-2-oxochromen-4-yl]acetamide

Drug info:

PubChemData

Smile

CCN(CCNC1=C2C=CC(=CC2=NC=C1)Cl)CC(=O)NCCOCCOCCNC(=O)CC3=CC(=O)OC4=C3C=CC(=C4)C(C)C

DOS

IR

Vibrations