Geometry & MOs

Info

ID:	285569
PubChem CID:	104113729
Reduced:	SN3O3C9H9 (1)
Stoich.:	AB3C3D9E9 (1)
Weight, g/mol:	276.077993
ΔH_f, kcal/mol:	-41.93
Dipole, Da:	6.63
IP(EA), eV:	-9.51(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(3-methylsulfonylpropylamino)-1,3-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

CN(CC1=CSC=N1)C2=NC(=CO2)C(=O)O

DOS

IR

Vibrations