Geometry & MOs

Info

ID:	285533
PubChem CID:	104110387
Reduced:	ClNOSC10H14 (1)
Stoich.:	ABCDE10F14 (1)
Weight, g/mol:	320.99313
ΔH_f, kcal/mol:	-48.86
Dipole, Da:	4.93
IP(EA), eV:	-9.58(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(4-chloropentan-2-yl)-5-fluorobenzamide

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NC(=O)C1=CC=CS1

DOS

IR

Vibrations