Geometry & MOs

Info

ID:	60174
PubChem CID:	26675830
Reduced:	ON2C19H20 (1)
Stoich.:	AB2C19D20 (1)
Weight, g/mol:	438.104956
ΔH_f, kcal/mol:	60.73
Dipole, Da:	3.05
IP(EA), eV:	-9.02(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)/C=N\OCC2=CC=CC=C2C#N

DOS

IR

Vibrations