Geometry & MOs

Info

ID:

181067

PubChem CID:

76715579

Reduced:

N2O5C33H44 (1)

Stoich.:

A2B5C33D44 (1)

Weight, g/mol:

670.340673

ΔHf, kcal/mol:

-184.45

Dipole, Da:

3.99

IP(EA), eV:

 -9.48(-0.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

14-[(3-methylphenyl)methyl]-18-(7-methyl-2-phenylquinolin-4-yl)oxy-2,15-dioxo-16-azatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1CCCCCC=CC2CC2(CC(=O)C3CC(CN3C1=O)O)C(=O)N4CCCC4C(=O)CCC5=CC=CC=C5

DOS

IR

Vibrations