Geometry & MOs

Info

ID:	356159
PubChem CID:	127291195
Reduced:	NSO2C7H11 (2)
Stoich.:	ABC2D7E11 (2)
Weight, g/mol:	268.124549
ΔH_f, kcal/mol:	-167.51
Dipole, Da:	6.06
IP(EA), eV:	-9.22(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(azetidine-1-carbonyl)-1,3-thiazolidin-3-yl]-cyclopentylmethanone

Drug info:

PubChemData

Smile

CN(C1CCS(=O)(=O)C1)C(=O)C2CSCN2C(=O)C3CCC3

DOS

IR

Vibrations