Geometry & MOs

Info

ID:	360592
PubChem CID:	127301237
Reduced:	SN3O3C11H17 (1)
Stoich.:	AB3C3D11E17 (1)
Weight, g/mol:	313.146013
ΔH_f, kcal/mol:	-48.03
Dipole, Da:	5.11
IP(EA), eV:	-9.65(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]-N-cyclopropyl-1,1-dioxothiolan-3-amine

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CN(C2CC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations