Geometry & MOs

Info

ID:	294102
PubChem CID:	117427147
Reduced:	ClNO4C12H12 (1)
Stoich.:	ABC4D12E12 (1)
Weight, g/mol:	269.045486
ΔH_f, kcal/mol:	-112.38
Dipole, Da:	6.61
IP(EA), eV:	-9.06(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(6-chlorospiro[1,3-benzodioxole-2,1'-cyclobutane]-5-yl)acetic acid

Drug info:

PubChemData

Smile

CNCC(=O)C1=CC(=C(C2=C1OCCO2)C=O)Cl

DOS

IR

Vibrations