Geometry & MOs

Info

ID:	364331
PubChem CID:	127315430
Reduced:	O2N4C19H30 (1)
Stoich.:	A2B4C19D30 (1)
Weight, g/mol:	336.216141
ΔH_f, kcal/mol:	-76.17
Dipole, Da:	2.57
IP(EA), eV:	-8.08(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-1-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]butan-1-one

Drug info:

PubChemData

Smile

CC1CCCCC1OCC(=O)NC2=NC=C(C=C2)N3CCN(CC3)C

DOS

IR

Vibrations