Geometry & MOs

Info

ID:	253954
PubChem CID:	103121807
Reduced:	ClO4N5H10C11 (1)
Stoich.:	AB4C5D10E11 (1)
Weight, g/mol:	219.11201
ΔH_f, kcal/mol:	-15.63
Dipole, Da:	4.28
IP(EA), eV:	-10.58(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopropyl-[5-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-3-yl]methanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)CN2C(=C(N=N2)C(=O)O)CN)[N+](=O)[O-]

DOS

IR

Vibrations