Geometry & MOs

Info

ID:	55721
PubChem CID:	17396126
Reduced:	FSN2O3C20H23 (1)
Stoich.:	ABC2D3E20F23 (1)
Weight, g/mol:	333.096085
ΔH_f, kcal/mol:	-140.51
Dipole, Da:	5.76
IP(EA), eV:	-9.61(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] 5-amino-3-methyl-1,2-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC(C)C3=CC=C(C=C3)F

DOS

IR

Vibrations