Geometry & MOs

Info

ID:	123275
PubChem CID:	50840182
Reduced:	ClS2F3N3O3H17C19 (1)
Stoich.:	AB2C3D3E3F17G19 (1)
Weight, g/mol:	420.022547
ΔH_f, kcal/mol:	-163.19
Dipole, Da:	5.18
IP(EA), eV:	-8.88(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluoro-2-methylphenyl)-2-methyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]thiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC(=CS3)C4=NOC(=C4)C(F)(F)F

DOS

IR

Vibrations