Geometry & MOs

Info

ID:	126124
PubChem CID:	50952978
Reduced:	ON4C15H24 (1)
Stoich.:	AB4C15D24 (1)
Weight, g/mol:	390.172562
ΔH_f, kcal/mol:	-26.36
Dipole, Da:	2.37
IP(EA), eV:	-8.8(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxyethyl)-N-[5-[2-(3-methylphenoxy)ethyl]-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1CCCCC1CCC(=O)N2CCC3=C(C2)C=NN3

DOS

IR

Vibrations