Geometry & MOs

Info

ID:	202438
PubChem CID:	79672326
Reduced:	NO3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	229.146664
ΔH_f, kcal/mol:	-86.92
Dipole, Da:	3.56
IP(EA), eV:	-8.64(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(2-azaspiro[3.4]octan-2-yl)phenyl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=CC=C1)N2CC(C2)(OC)OC

DOS

IR

Vibrations