Geometry & MOs

Info

ID:	233214
PubChem CID:	89449338
Reduced:	NO2H11C12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	141.024835
ΔH_f, kcal/mol:	-12.98
Dipole, Da:	5.53
IP(EA), eV:	-9.07(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethylidene-5-sulfanylidenepyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=NOC(=C1NC(=O)O[C@H](C)C2=CC=CC=C2)C#CC3=CC=C(C=C3)CCC=O

DOS

IR

Vibrations