Geometry & MOs

Info

ID:

164142

PubChem CID:

74382087

Reduced:

N6O11C37H50 (1)

Stoich.:

A6B11C37D50 (1)

Weight, g/mol:

539.082177

ΔHf, kcal/mol:

-482.99

Dipole, Da:

9.52

IP(EA), eV:

 -8.96(-0.5)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[7-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-yl] 2-(4-chlorophenyl)-6,6-dimethylcyclohexa-1,3-diene-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CC(=O)O)NC(=O)C3CCCN3C(=O)C(C(C)O)N

DOS

IR

Vibrations