Geometry & MOs

Info

ID:	253955
PubChem CID:	103121818
Reduced:	ON5C10H13 (1)
Stoich.:	AB5C10D13 (1)
Weight, g/mol:	207.11201
ΔH_f, kcal/mol:	87.77
Dipole, Da:	5.79
IP(EA), eV:	-9.56(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-3-yl]propan-2-amine

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C2=NC(=NO2)C(C3CC3)N

DOS

IR

Vibrations