Geometry & MOs

Info

ID:	220884
PubChem CID:	85240261
Reduced:	ClO4C14H15 (1)
Stoich.:	AB4C14D15 (1)
Weight, g/mol:	282.102272
ΔH_f, kcal/mol:	-146.61
Dipole, Da:	2.47
IP(EA), eV:	-9.1(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-1,5-dihydroxy-2,2,5-trimethyl-7-methylidenespiro[1,3-dihydroindene-6,1'-cyclopropane]-4-one

Drug info:

PubChemData

Smile

CCOC(=O)C(=CC1=CC(=CC=C1)OC)CC(=O)Cl

DOS

IR

Vibrations