Geometry & MOs

Info

ID:	368355
PubChem CID:	127328025
Reduced:	SO2N4C13H22 (1)
Stoich.:	AB2C4D13E22 (1)
Weight, g/mol:	334.157581
ΔH_f, kcal/mol:	-68.32
Dipole, Da:	5.08
IP(EA), eV:	-9.38(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-tert-butyl-1,2,4-thiadiazol-5-yl)-2-(1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NSC(=N1)NC(=O)NCC2CCCOC2

DOS

IR

Vibrations