Geometry & MOs

Info

ID:	422540
PubChem CID:	135118009
Reduced:	SO2N4C16H22 (1)
Stoich.:	AB2C4D16E22 (1)
Weight, g/mol:	348.148535
ΔH_f, kcal/mol:	-10.87
Dipole, Da:	6.71
IP(EA), eV:	-9.03(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[cyclopentylmethyl(methyl)amino]-5-(4-fluoro-3-methoxyphenyl)-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CCCOC1CCCN(C1)C2=NN=C(O2)CSC3=CC=NC=C3

DOS

IR

Vibrations