Geometry & MOs

Info

ID:

222689

PubChem CID:

85320482

Reduced:

N8O13C47H60 (1)

Stoich.:

A8B13C47D60 (1)

Weight, g/mol:

946.444469

ΔHf, kcal/mol:

-553.17

Dipole, Da:

16.05

IP(EA), eV:

 -9.3(-0.87)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[1,3-bis(phenylmethoxy)propan-2-yloxy]-3,4,5-tris(phenylmethoxy)-6-(trityloxymethyl)oxane

Drug info:

PubChemData

Smile

CC(C)CC(C(CNC(CC(=O)O)C(=O)NC(C)C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)N)O)NC(=O)C(CC(=O)N)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

DOS

IR

Vibrations