Geometry & MOs

Info

ID:	270316
PubChem CID:	103636028
Reduced:	ON4C10H12 (1)
Stoich.:	AB4C10D12 (1)
Weight, g/mol:	449.98037
ΔH_f, kcal/mol:	16.85
Dipole, Da:	5.34
IP(EA), eV:	-10.32(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-iodo-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

CCC(C#N)NC(=O)C1=NC=C(N=C1)C

DOS

IR

Vibrations