Geometry & MOs

Info

ID:	50225
PubChem CID:	12012736
Reduced:	ClSeO2C14H19 (1)
Stoich.:	ABC2D14E19 (1)
Weight, g/mol:	259.095691
ΔH_f, kcal/mol:	-104.63
Dipole, Da:	2.4
IP(EA), eV:	-8.82(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetyl-1',5-dimethylspiro[1,3,4-oxadiazole-2,3'-indole]-2'-one

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]([C@@H](C(C)C)Cl)[Se]C1=CC=CC=C1

DOS

IR

Vibrations