Geometry & MOs

Info

ID:	365407
PubChem CID:	127317806
Reduced:	S2N3O3C15H23 (1)
Stoich.:	A2B3C3D15E23 (1)
Weight, g/mol:	301.146013
ΔH_f, kcal/mol:	-124.56
Dipole, Da:	8.01
IP(EA), eV:	-9.49(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclobutyl-N-(1,1-dioxothiolan-3-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=CSC(=N1)C2CCCN(C2)C(=O)NC3CCS(=O)(=O)C3

DOS

IR

Vibrations