Geometry & MOs

Info

ID:	293220
PubChem CID:	117376831
Reduced:	OSN3C12H15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	38.47
Dipole, Da:	4.45
IP(EA), eV:	-8.26(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxy-2-propan-2-yloxyphenyl)piperidine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)SC)C2=NOC(=N2)CN

DOS

IR

Vibrations