Geometry & MOs

Info

ID:	415725
PubChem CID:	135088725
Reduced:	SN2O4C16H24 (1)
Stoich.:	AB2C4D16E24 (1)
Weight, g/mol:	336.11215
ΔH_f, kcal/mol:	-163.41
Dipole, Da:	2.52
IP(EA), eV:	-9.47(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-fluoro-3-methoxyphenyl)-3-(oxolan-3-ylmethylamino)-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N[C@@H]2COC[C@H]2CS(=O)(=O)N(C)C)C

DOS

IR

Vibrations