Geometry & MOs

Info

ID:	305806
PubChem CID:	124970008
Reduced:	SN3O3C11H15 (1)
Stoich.:	AB3C3D11E15 (1)
Weight, g/mol:	319.189592
ΔH_f, kcal/mol:	-94.55
Dipole, Da:	1.95
IP(EA), eV:	-9.3(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-[(3R,4R)-4-hydroxyoxolan-3-yl]piperidin-4-yl]-N,N-dimethylpyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCO[C@](C1)(C)C(=O)NC2=NC=CS2

DOS

IR

Vibrations