Geometry & MOs

Info

ID:	20543
PubChem CID:	584555
Reduced:	NSO4C15H17 (1)
Stoich.:	ABC4D15E17 (1)
Weight, g/mol:	307.087829
ΔH_f, kcal/mol:	-122.12
Dipole, Da:	5.31
IP(EA), eV:	-9.57(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methyl-2-[4-oxo-2-(2-thiophen-2-ylethenyl)-1,3-oxazol-5-yl]propyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OCC(C)(C)C1C(=O)N=C(O1)C=CC2=CC=CS2

DOS

IR

Vibrations