Geometry & MOs

Info

ID:	350124
PubChem CID:	127277202
Reduced:	N2S2O4C15H28 (1)
Stoich.:	A2B2C4D15E28 (1)
Weight, g/mol:	364.156912
ΔH_f, kcal/mol:	-191.9
Dipole, Da:	7.2
IP(EA), eV:	-8.95(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]sulfonyl-[1,2]oxazolo[5,4-b]pyridine

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2CCCN2S(=O)(=O)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations