Geometry & MOs

Info

ID:	150111
PubChem CID:	53789797
Reduced:	S3N5O5C31H59 (1)
Stoich.:	A3B5C5D31E59 (1)
Weight, g/mol:	170.105528
ΔH_f, kcal/mol:	-279.83
Dipole, Da:	6.32
IP(EA), eV:	-8.24(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-aminoethyl)-3-ethylpyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CCCNC(CCCCC(C)(C)S)(CN(CCC)CNC(=S)C)O.CCC1CC(=O)N(C1=O)CCN.C1C(C(=O)CS1)C=O

DOS

IR

Vibrations