Geometry & MOs

Info

ID:	79058
PubChem CID:	49746608
Reduced:	O2S2N5C15H15 (1)
Stoich.:	A2B2C5D15E15 (1)
Weight, g/mol:	362.141262
ΔH_f, kcal/mol:	66.89
Dipole, Da:	3.65
IP(EA), eV:	-8.93(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,6-dimethylmorpholin-4-yl)-2-[3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CSC(=N1)NC(=O)CN2CC(C2)C3=NC(=NO3)C4=CC=CS4

DOS

IR

Vibrations