Geometry & MOs

Info

ID:	277388
PubChem CID:	103828191
Reduced:	N2O2F3C13H13 (1)
Stoich.:	A2B2C3D13E13 (1)
Weight, g/mol:	347.9665
ΔH_f, kcal/mol:	-191.32
Dipole, Da:	3.67
IP(EA), eV:	-9.41(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-chloro-N-(4-cyanophenyl)-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(C1=CC=C(C=C1)C#N)C(=O)CCOCC(F)(F)F

DOS

IR

Vibrations