Geometry & MOs

Info

ID:

422619

PubChem CID:

135118151

Reduced:

N7O7C36H47 (1)

Stoich.:

A7B7C36D47 (1)

Weight, g/mol:

380.211136

ΔHf, kcal/mol:

-181.87

Dipole, Da:

8.57

IP(EA), eV:

 -8.76(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(4-fluorophenyl)ethyl]-2-[4-hydroxy-4-(hydroxymethyl)-1-oxa-9-azaspiro[5.5]undecan-9-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)[C@@H]1C(=O)NCCCC2=CC(=C(C=C2)OC)OCC(=O)NCCC[C@@H](C(=O)N[C@H](C(=O)N1)CC3=CC=CC=C3)NC(=O)C4=CN=CN4C

DOS

IR

Vibrations