Geometry & MOs

Info

ID:	442306
PubChem CID:	135251212
Reduced:	NO2C17H25 (1)
Stoich.:	AB2C17D25 (1)
Weight, g/mol:	388.160992
ΔH_f, kcal/mol:	-87.75
Dipole, Da:	3.2
IP(EA), eV:	-9.46(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1,1,1-trifluoro-3-hydroxypropan-2-yl] 2-(2-methoxypyridin-4-yl)-7-azaspiro[3.5]nonane-7-carboxylate

Drug info:

PubChemData

Smile

C1CCCC(C(CCC1)N)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations