Geometry & MOs

Info

ID:	314980
PubChem CID:	126624082
Reduced:	NOCl2C9H11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	195.033003
ΔH_f, kcal/mol:	-51.44
Dipole, Da:	3.51
IP(EA), eV:	-9.43(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(azetidin-3-yl)-1H-pyrazole;dihydrochloride

Drug info:

PubChemData

Smile

CCOC1=NC(=CC(=C1CCl)Cl)C

DOS

IR

Vibrations