Geometry & MOs

Info

ID:	292946
PubChem CID:	117365836
Reduced:	NO2S2C10H15 (1)
Stoich.:	AB2C2D10E15 (1)
Weight, g/mol:	245.177964
ΔH_f, kcal/mol:	-62.06
Dipole, Da:	6.47
IP(EA), eV:	-8.63(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-methoxy-2,3-dihydro-1H-inden-4-yl)methyl]piperidine

Drug info:

PubChemData

Smile

CSC1=C(C=C(C=C1)CCN)S(=O)(=O)C

DOS

IR

Vibrations