Geometry & MOs

Info

ID:

417150

PubChem CID:

135091459

Reduced:

FN6O6C34H43 (1)

Stoich.:

AB6C6D34E43 (1)

Weight, g/mol:

355.189592

ΔHf, kcal/mol:

-259.95

Dipole, Da:

5.73

IP(EA), eV:

 -9.04(-1.59)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(2S,4R)-4-hydroxypyrrolidin-2-yl]-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylmethanone

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N[C@H](CN(CC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC2=CC=C(C=C2)OC)CC(C)C)C(=O)C3=CC(=CC(=C3)C#N)F)C(C)C

DOS

IR

Vibrations