Geometry & MOs

Info

ID:	56869
PubChem CID:	22394578
Reduced:	N3O3H13C15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	228.035734
ΔH_f, kcal/mol:	3.25
Dipole, Da:	3.32
IP(EA), eV:	-8.8(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-(1,3-thiazol-2-ylmethylidene)-1H-indol-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(N1)/C=C/2\C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O)C

DOS

IR

Vibrations