Geometry & MOs

Info

ID:	277100
PubChem CID:	103826710
Reduced:	BrClOSN2C14H14 (1)
Stoich.:	ABCDE2F14G14 (1)
Weight, g/mol:	330.01345
ΔH_f, kcal/mol:	-14.84
Dipole, Da:	3.09
IP(EA), eV:	-9.32(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-(1-methylpiperidin-3-yl)benzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)C(C)NC(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations