Geometry & MOs

Info

ID:	419631
PubChem CID:	135108566
Reduced:	SO4N5C20H27 (1)
Stoich.:	AB4C5D20E27 (1)
Weight, g/mol:	328.153541
ΔH_f, kcal/mol:	-113.46
Dipole, Da:	2.13
IP(EA), eV:	-9.4(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzoyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1)CC(=O)N[C@@]2(CCOC3([C@H]2O)CCN(CC3)C(=O)C4=CSC=N4)C

DOS

IR

Vibrations