Geometry & MOs

Info

ID:

394136

PubChem CID:

135022406

Reduced:

N2O5C21H23 (2)

Stoich.:

A2B5C21D23 (2)

Weight, g/mol:

535.23185

ΔHf, kcal/mol:

-331.57

Dipole, Da:

7.6

IP(EA), eV:

 -8.7(-0.39)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzyl 2-[[3-[3-amino-2-(methoxymethoxy)phenyl]-2-(methoxymethoxy)phenyl]carbamoyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

COCOC1=C(C=CC=C1NC(=O)C2CCCN2C(=O)OCC3=CC=CC=C3)C4=C(C(=CC=C4)NC(=O)C5CCCN5C(=O)OCC6=CC=CC=C6)OCOC

DOS

IR

Vibrations