Geometry & MOs

Info

ID:	235831
PubChem CID:	92710750
Reduced:	SO2N6C19H30 (1)
Stoich.:	AB2C6D19E30 (1)
Weight, g/mol:	406.215095
ΔH_f, kcal/mol:	-60.67
Dipole, Da:	6.3
IP(EA), eV:	-8.33(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-N-(3-pyrrolidin-1-ylpropyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)CCCNC(=O)[C@@H]2CCCN(C2)C3=NN=C(S3)N4CCCC4=O

DOS

IR

Vibrations