Geometry & MOs

Info

ID:	250417
PubChem CID:	103096437
Reduced:	O2N4C11H16 (1)
Stoich.:	A2B4C11D16 (1)
Weight, g/mol:	209.080041
ΔH_f, kcal/mol:	-3.98
Dipole, Da:	2.8
IP(EA), eV:	-9.67(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(5-methyl-1,2-oxazol-3-yl)-1,2,4-oxadiazol-3-yl]propan-1-ol

Drug info:

PubChemData

Smile

CCC(C1=NOC(=N1)C2=CC(=NN2CC)C)O

DOS

IR

Vibrations