Geometry & MOs

Info

ID:

214886

PubChem CID:

85083802

Reduced:

N7O11C26H47 (1)

Stoich.:

A7B11C26D47 (1)

Weight, g/mol:

633.373764

ΔHf, kcal/mol:

-557.98

Dipole, Da:

5.19

IP(EA), eV:

 -10.2(-0.25)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[[2-[2-[2-[2-[2-hydroxy-3-[2-(2-methoxyethoxy)ethoxy]phenyl]imidazolidin-1-yl]ethylamino]ethylamino]ethylamino]methylidene]-2-[2-(2-methoxyethoxy)ethoxy]cyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NC(C(C)O)C(=O)O)NC(=O)C(C(C)C)NC(=O)C(CO)NC(=O)C(C(C)O)NC(=O)C(CC(=O)N)N

DOS

IR

Vibrations