Geometry & MOs

Info

ID:	277051
PubChem CID:	103826491
Reduced:	BrClN2O2C14H16 (1)
Stoich.:	ABC2D2E14F16 (1)
Weight, g/mol:	358.00837
ΔH_f, kcal/mol:	-74.98
Dipole, Da:	3.21
IP(EA), eV:	-9.6(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-acetylpiperidin-4-yl)-3-bromo-5-chlorobenzamide

Drug info:

PubChemData

Smile

CC(=O)N1CCCN(CC1)C(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations