Geometry & MOs

Info

ID:	346910
PubChem CID:	127271414
Reduced:	SO3N4C14H16 (1)
Stoich.:	AB3C4D14E16 (1)
Weight, g/mol:	369.216475
ΔH_f, kcal/mol:	-114.85
Dipole, Da:	8.34
IP(EA), eV:	-8.36(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-piperidin-1-yl-3-[4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)C(=O)N)C(=O)NC2=CC3=C(C=C2)SCC(=O)N3

DOS

IR

Vibrations