Geometry & MOs

Info

ID:	351215
PubChem CID:	127279773
Reduced:	O3N5C20H33 (1)
Stoich.:	A3B5C20D33 (1)
Weight, g/mol:	295.153206
ΔH_f, kcal/mol:	-106.17
Dipole, Da:	6.35
IP(EA), eV:	-8.92(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dioxan-2-yl-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCN(CC)C(=O)N1CCC(CC1)C(=O)N2CCCC(C2)CC3=NOC(=N3)C

DOS

IR

Vibrations