Geometry & MOs

Info

ID:	279282
PubChem CID:	103842817
Reduced:	BrClON4H8C10 (1)
Stoich.:	ABCD4E8F10 (1)
Weight, g/mol:	355.0087
ΔH_f, kcal/mol:	32.69
Dipole, Da:	4.19
IP(EA), eV:	-9.38(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-(4-cyano-1-methylpiperidin-4-yl)benzamide

Drug info:

PubChemData

Smile

CC1=NC(=NN1)NC(=O)C2=CC(=C(C=C2)Cl)Br

DOS

IR

Vibrations