Geometry & MOs

Info

ID:	361355
PubChem CID:	127302664
Reduced:	OSN5C19H27 (1)
Stoich.:	ABC5D19E27 (1)
Weight, g/mol:	384.092597
ΔH_f, kcal/mol:	3.8
Dipole, Da:	4.67
IP(EA), eV:	-8.2(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-[1-(5-ethyl-1,3,4-oxadiazol-2-yl)ethylsulfanyl]pyridin-3-yl]sulfonylmorpholine

Drug info:

PubChemData

Smile

CC1=C(N(C(=N1)SC2CCN(C2=O)C3=CN(N=C3)C)C4CCCCC4)C

DOS

IR

Vibrations