Geometry & MOs

Info

ID:

302319

PubChem CID:

124361228

Reduced:

N3O4C26H31 (1)

Stoich.:

A3B4C26D31 (1)

Weight, g/mol:

443.161184

ΔHf, kcal/mol:

-153.24

Dipole, Da:

4.17

IP(EA), eV:

 -9.16(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3S,3'R,5'R)-N-(5-chloro-2-methoxyphenyl)-5'-[(1R)-1-hydroxyethyl]-5,7-dimethyl-2-oxospiro[1H-indole-3,2'-pyrrolidine]-3'-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C@@H]2C[C@@H](N[C@]23C4=CC=CC(=C4NC3=O)C)CC(C)C

DOS

IR

Vibrations