Geometry & MOs

Info

ID:	171993
PubChem CID:	75450965
Reduced:	O2S2N3H13C20 (1)
Stoich.:	A2B2C3D13E20 (1)
Weight, g/mol:	231.100777
ΔH_f, kcal/mol:	60.21
Dipole, Da:	7.53
IP(EA), eV:	-9.06(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-phenyl-1,2,4-oxadiazol-3-yl)morpholine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(N=C(S2)/C=C/C3=CSC(=N3)C4=CC=CC=N4)C(=O)O

DOS

IR

Vibrations