Geometry & MOs

Info

ID:	274322
PubChem CID:	103808548
Reduced:	BrN2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	325.07897
ΔH_f, kcal/mol:	-66.0
Dipole, Da:	3.48
IP(EA), eV:	-8.96(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-aminopiperidin-1-yl)-N-(3-bromo-2-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Br)NC(=O)C2COCCN2

DOS

IR

Vibrations