Geometry & MOs

Info

ID:	37556
PubChem CID:	8022198
Reduced:	BrNO4C19H20 (1)
Stoich.:	ABC4D19E20 (1)
Weight, g/mol:	361.06774
ΔH_f, kcal/mol:	-132.01
Dipole, Da:	4.72
IP(EA), eV:	-8.89(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-bromonaphthalen-2-yl)oxy-1-[(2R)-2-methylpiperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

COC(=O)C1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C=C(C=C3)Br

DOS

IR

Vibrations