Geometry & MOs

Info

ID:

44696

PubChem CID:

10505433

Reduced:

NO3C14H18 (2)

Stoich.:

AB3C14D18 (2)

Weight, g/mol:

496.236208

ΔHf, kcal/mol:

-266.97

Dipole, Da:

4.87

IP(EA), eV:

 -8.62(0.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1R,8R,9R,13R)-N-methoxy-11-[2-(2-methoxyphenyl)acetyl]-1-phenyl-11-azatetracyclo[6.5.2.02,7.09,13]pentadeca-2,4,6-triene-9-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC1=CC=C(C=C1)C[C@@H](C(=O)N2CC3=CC=CC=C3C[C@H]2C(=O)O)NC(=O)OC(C)(C)C

DOS

IR

Vibrations