Geometry & MOs

Info

ID:	341757
PubChem CID:	127264450
Reduced:	Cl2N2C7H10 (1)
Stoich.:	A2B2C7D10 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-11.54
Dipole, Da:	1.87
IP(EA), eV:	-8.92(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-oxospiro[2H-isoindole-1,3'-azetidine]-1'-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NN)Cl.Cl

DOS

IR

Vibrations