Geometry & MOs

Info

ID:

432444

PubChem CID:

135172577

Reduced:

Cl2O3N5C30H35 (1)

Stoich.:

A2B3C5D30E35 (1)

Weight, g/mol:

660.366219

ΔHf, kcal/mol:

-91.2

Dipole, Da:

6.1

IP(EA), eV:

 -8.41(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[3-[2-[2-(hydroxymethyl)prop-2-enoyloxy]ethoxy]-5-[4-(6-pentylnaphthalen-2-yl)phenyl]cyclohexyl]oxyethyl 3-hydroxy-2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CNC1=CC=CC(=C1Cl)C2=C(C(=CC=C2)NC(=O)C3=NC4=C(N3C)CCN(C4)CCC5CCC(CC5)C(=O)O)Cl

DOS

IR

Vibrations