Geometry & MOs

Info

ID:

395467

PubChem CID:

135025538

Reduced:

N2O2Si2C31H67 (1)

Stoich.:

A2B2C2D31E67 (1)

Weight, g/mol:

651.474107

ΔHf, kcal/mol:

-258.72

Dipole, Da:

1.13

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.754821

Charge, e:

1

Chem-info

IUPAC name:

[(2R)-1-[(4S,5S)-4,5-diphenyl-3-[(2R)-2-tri(propan-2-yl)silyloxypropyl]-4,5-dihydroimidazol-1-ium-1-yl]propan-2-yl]oxy-tri(propan-2-yl)silane

Drug info:

PubChemData

Smile

CC(C)[C@@H](CO[Si](C(C)C)(C(C)C)C(C)C)N1CC[N+](=C1)[C@H](CO[Si](C(C)C)(C(C)C)C(C)C)C(C)C

DOS

IR

Vibrations