Geometry & MOs

Info

ID:	277098
PubChem CID:	103826703
Reduced:	BrClN2O2C11H12 (1)
Stoich.:	ABC2D2E11F12 (1)
Weight, g/mol:	370.04475
ΔH_f, kcal/mol:	-75.7
Dipole, Da:	1.53
IP(EA), eV:	-9.85(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C(=O)NC)NC(=O)C1=CC(=CC(=C1)Br)Cl

DOS

IR

Vibrations