Geometry & MOs

Info

ID:	363488
PubChem CID:	127311291
Reduced:	O3N6C19H32 (1)
Stoich.:	A3B6C19D32 (1)
Weight, g/mol:	356.151826
ΔH_f, kcal/mol:	-87.63
Dipole, Da:	2.59
IP(EA), eV:	-8.94(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfonyl-1-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCN(CC)C(=O)N1CCC(CC1)C(=O)N2CCN(CC2)CC3=NOC(=N3)C

DOS

IR

Vibrations