Geometry & MOs

Info

ID:

49597

PubChem CID:

11533334

Reduced:

O2P2H30C31 (1)

Stoich.:

A2B2C30D31 (1)

Weight, g/mol:

496.238493

ΔHf, kcal/mol:

-16.39

Dipole, Da:

0.99

IP(EA), eV:

 -8.73(0.17)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenylacetamide;hexanedioic acid

Drug info:

PubChemData

Smile

C1[C@H]2C[C@H]([C@H]2C[C@H]1OP(C3=CC=CC=C3)C4=CC=CC=C4)OP(C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations