Geometry & MOs

Info

ID:	398519
PubChem CID:	135033660
Reduced:	NO3C18H19 (1)
Stoich.:	AB3C18D19 (1)
Weight, g/mol:	218.985384
ΔH_f, kcal/mol:	-78.66
Dipole, Da:	3.17
IP(EA), eV:	-9.46(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-but-3-enyl-3,4-dichloropyrrole-2,5-dione

Drug info:

PubChemData

Smile

CCN(CC)C(=O)OC1=CC=CC=C1C(=O)C2=CC=CC=C2

DOS

IR

Vibrations