Geometry & MOs

Info

ID:	351209
PubChem CID:	127279767
Reduced:	SN4O4C15H24 (1)
Stoich.:	AB4C4D15E24 (1)
Weight, g/mol:	386.243024
ΔH_f, kcal/mol:	-124.94
Dipole, Da:	6.2
IP(EA), eV:	-9.41(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)CN3CCS(=O)(=O)CC3

DOS

IR

Vibrations