Geometry & MOs

Info

ID:	159342
PubChem CID:	57269621
Reduced:	NOSC10H21 (1)
Stoich.:	ABCD10E21 (1)
Weight, g/mol:	268.178693
ΔH_f, kcal/mol:	-76.7
Dipole, Da:	4.78
IP(EA), eV:	-8.76(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-4-methyl-2-[(5S)-6-oxo-1,7-diazaspiro[4.4]nonan-7-yl]pentanoate

Drug info:

PubChemData

Smile

CCCCCCOC(=S)NCCC

DOS

IR

Vibrations