Geometry & MOs

Info

ID:

167456

PubChem CID:

74830325

Reduced:

PN6O14C36H51 (1)

Stoich.:

AB6C14D36E51 (1)

Weight, g/mol:

1720.930469

ΔHf, kcal/mol:

-615.91

Dipole, Da:

2.08

IP(EA), eV:

 -9.1(-0.9)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1,4,7-tris[[4-[1,2-bis[[4-(2,2-dimethyl-1,3-dioxolan-4-yl)phenyl]methoxy]ethyl]phenyl]methyl]-1,4,7-triazonane

Drug info:

PubChemData

Smile

CCCCOC(=O)N1CCN(CC1)C(=O)C(CP(=O)(OCOC(=O)OCC)OCOC(=O)OCC)NC(=O)C2=CC(=NC(=N2)C3=CC=CC=C3)N4CCC(C4)OC

DOS

IR

Vibrations