Geometry & MOs

Info

ID:	28079
PubChem CID:	825402
Reduced:	O3H12C13 (1)
Stoich.:	A3B12C13 (1)
Weight, g/mol:	279.031377
ΔH_f, kcal/mol:	-70.02
Dipole, Da:	3.17
IP(EA), eV:	-9.14(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(4-methoxy-3-nitrophenyl)methylidene]-2-sulfanylideneimidazolidin-4-one

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OC(=O)C2=CC=CO2)C

DOS

IR

Vibrations