Geometry & MOs

Info

ID:	60167
PubChem CID:	26675816
Reduced:	SN3O6H19C21 (1)
Stoich.:	AB3C6D19E21 (1)
Weight, g/mol:	456.115521
ΔH_f, kcal/mol:	-93.83
Dipole, Da:	7.33
IP(EA), eV:	-9.17(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-N-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl]-N-(furan-2-ylmethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC3=NOC(=C3)C4=CC=CO4

DOS

IR

Vibrations