Geometry & MOs

Info

ID:

215333

PubChem CID:

85084559

Reduced:

N10O13C34H60 (1)

Stoich.:

A10B13C34D60 (1)

Weight, g/mol:

816.350962

ΔHf, kcal/mol:

-634.11

Dipole, Da:

8.86

IP(EA), eV:

 -9.89(-0.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-[[4,5-bis(phenylmethoxy)-2,7-dioxabicyclo[4.1.0]heptan-3-yl]methoxy]-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-3-yl] acetate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations