Geometry & MOs

Info

ID:	363484
PubChem CID:	127311287
Reduced:	SO2N6C17H26 (1)
Stoich.:	AB2C6D17E26 (1)
Weight, g/mol:	363.22704
ΔH_f, kcal/mol:	-9.6
Dipole, Da:	3.42
IP(EA), eV:	-8.26(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CN2CCN(CC2)C(=O)CSC3=NC=CN3C(C)(C)C

DOS

IR

Vibrations