Geometry & MOs

Info

ID:	366650
PubChem CID:	127320179
Reduced:	SO2N6C16H20 (1)
Stoich.:	AB2C6D16E20 (1)
Weight, g/mol:	364.141452
ΔH_f, kcal/mol:	59.96
Dipole, Da:	4.78
IP(EA), eV:	-8.61(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloropyridin-2-yl)-2-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CN2CCN(CC2)C(C)C3=NN=C(O3)C4=CC=CS4

DOS

IR

Vibrations