Geometry & MOs

Info

ID:	17161
PubChem CID:	486517
Reduced:	ClSN2F4O5H17C23 (1)
Stoich.:	ABC2D4E5F17G23 (1)
Weight, g/mol:	544.048283
ΔH_f, kcal/mol:	-337.68
Dipole, Da:	8.42
IP(EA), eV:	-9.44(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-chloro-2-[3-fluoro-5-(trifluoromethyl)benzoyl]phenoxy]-N-(2-methyl-4-sulfamoylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)S(=O)(=O)N)NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)C3=CC(=CC(=C3)F)C(F)(F)F

DOS

IR

Vibrations