Geometry & MOs

Info

ID:	361627
PubChem CID:	127303917
Reduced:	O3N5C16H21 (1)
Stoich.:	A3B5C16D21 (1)
Weight, g/mol:	363.22704
ΔH_f, kcal/mol:	-44.1
Dipole, Da:	3.17
IP(EA), eV:	-8.98(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=NC(=NO1)CN2CCN(CC2)C(=O)C3=CN(C(=O)C=C3)C

DOS

IR

Vibrations