Geometry & MOs

Info

ID:

412347

PubChem CID:

135085237

Reduced:

P2O7C59H78 (1)

Stoich.:

A2B7C59D78 (1)

Weight, g/mol:

333.202562

ΔHf, kcal/mol:

-261.08

Dipole, Da:

2.97

IP(EA), eV:

 -8.33(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 1

Chem-info

IUPAC name:

2-[2-[2-[3-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]imidazol-3-ium-1-yl]ethoxy]ethoxy]ethanol

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=CC(=C1OC)C(C)(C)C)PC2=C(C3=C(C=C2)OCO3)C4=C(C=CC5=C4OCO5)P(C6=CC(=C(C(=C6)C(C)(C)C)OC)C(C)(C)C)C7=CC(=C(C(=C7)C(C)(C)C)OC)C(C)(C)C

DOS

IR

Vibrations