Geometry & MOs

Info

ID:	383476
PubChem CID:	134975218
Reduced:	SN2O4C13H20 (1)
Stoich.:	AB2C4D13E20 (1)
Weight, g/mol:	322.074228
ΔH_f, kcal/mol:	-118.09
Dipole, Da:	6.35
IP(EA), eV:	-9.27(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3E)-1-oxo-3-(3-oxo-1H-inden-2-ylidene)inden-2-ylidene]propanedinitrile

Drug info:

PubChemData

Smile

CC(=O)N(CCCS(=O)(=O)NC)OCC1=CC=CC=C1

DOS

IR

Vibrations