Geometry & MOs

Info

ID:	207712
PubChem CID:	80441089
Reduced:	N4C13H22 (1)
Stoich.:	A4B13C22 (1)
Weight, g/mol:	250.142976
ΔH_f, kcal/mol:	13.06
Dipole, Da:	1.32
IP(EA), eV:	-9.32(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1-[3-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-5-yl]pentan-2-ol

Drug info:

PubChemData

Smile

CC(C)CC1=CC(=NC(=N1)C2CCCC2)NN

DOS

IR

Vibrations