Geometry & MOs

Info

ID:	169148
PubChem CID:	75067894
Reduced:	NO2H10C11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	291.173548
ΔH_f, kcal/mol:	-56.73
Dipole, Da:	6.01
IP(EA), eV:	-8.36(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[naphthalen-2-yl(pyrazol-1-yl)methyl]piperidine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)NN)C(=O)C=C1O

DOS

IR

Vibrations