Geometry & MOs

Info

ID:	220314
PubChem CID:	85177287
Reduced:	OC8H10 (2)
Stoich.:	AB8C10 (2)
Weight, g/mol:	244.157563
ΔH_f, kcal/mol:	-56.01
Dipole, Da:	1.57
IP(EA), eV:	-9.34(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3,4-diethyl-1H-pyrrol-2-yl)methylidene]-3,4-dimethylpyrrol-2-one

Drug info:

PubChemData

Smile

CC(C=C(C)CC(=C)C(=O)OC)C1=CC=CC=C1

DOS

IR

Vibrations