Geometry & MOs

Info

ID:	292526
PubChem CID:	115354171
Reduced:	BrO2C15H15 (1)
Stoich.:	AB2C15D15 (1)
Weight, g/mol:	346.06808
ΔH_f, kcal/mol:	-60.3
Dipole, Da:	2.12
IP(EA), eV:	-9.44(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-N-(piperidin-3-ylmethyl)naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CCCCOC(=O)C1=CC2=C(C=C1)C=C(C=C2)Br

DOS

IR

Vibrations