Geometry & MOs

Info

ID:	279248
PubChem CID:	103842277
Reduced:	BrON2C13H15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	317.0182
ΔH_f, kcal/mol:	-5.91
Dipole, Da:	3.66
IP(EA), eV:	-9.52(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-methyl-N-(2-methylbutan-2-yl)benzamide

Drug info:

PubChemData

Smile

C1CC=C(C1)CCNC(=O)C2=CC(=CN=C2)Br

DOS

IR

Vibrations