Geometry & MOs

Info

ID:	295130
PubChem CID:	117518253
Reduced:	BrO4C16H17 (1)
Stoich.:	AB4C16D17 (1)
Weight, g/mol:	352.03102
ΔH_f, kcal/mol:	-112.35
Dipole, Da:	3.72
IP(EA), eV:	-9.24(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-bromospiro[1,3-benzodioxole-2,1'-cyclobutane]-5-yl)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(C1)(C2=CC3=C(C(=C2)Br)OCC4(CC4)CO3)C(=O)O

DOS

IR

Vibrations