Geometry & MOs

Info

ID:	396564
PubChem CID:	135028781
Reduced:	O2H26C27 (1)
Stoich.:	A2B26C27 (1)
Weight, g/mol:	217.030983
ΔH_f, kcal/mol:	-2.05
Dipole, Da:	1.31
IP(EA), eV:	-9.21(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-indol-2-ylidene-1,3,4-oxadiazolidine-2-thione

Drug info:

PubChemData

Smile

CCOC(=O)/C=C(/C1[C@@H]([C@@H]1C2=CC=CC=C2)C3=CC=CC=C3)\C4=CC=C(C=C4)C

DOS

IR

Vibrations