Geometry & MOs

Info

ID:

237759

PubChem CID:

92721366

Reduced:

N3O5C28H35 (1)

Stoich.:

A3B5C28D35 (1)

Weight, g/mol:

463.210721

ΔHf, kcal/mol:

-137.66

Dipole, Da:

4.2

IP(EA), eV:

 -8.24(-0.55)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-10-(1,3-benzodioxol-5-ylmethyl)-N-cycloheptyl-11-methyl-9-oxo-5-oxa-1,10-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7-triene-11-carboxamide

Drug info:

PubChemData

Smile

C[C@@]1(CN2C3=C(C=C2C(=O)N1CCC4=CC(=C(C=C4)OC)OC)OC=C3)C(=O)NC5CCCCCC5

DOS

IR

Vibrations