Geometry & MOs

Info

ID:	246906
PubChem CID:	103065524
Reduced:	OSN2C9H16 (1)
Stoich.:	ABC2D9E16 (1)
Weight, g/mol:	256.160935
ΔH_f, kcal/mol:	-49.83
Dipole, Da:	2.26
IP(EA), eV:	-8.76(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-5-(2-methylpropyl)-3-(thiolan-3-yl)imidazolidin-4-one

Drug info:

PubChemData

Smile

CCC1C(=O)N(CN1)C2CCSC2

DOS

IR

Vibrations