Geometry & MOs

Info

ID:	411307
PubChem CID:	135084120
Reduced:	Cl4C5H6 (1)
Stoich.:	A4B5C6 (1)
Weight, g/mol:	210.125594
ΔH_f, kcal/mol:	-33.05
Dipole, Da:	2.37
IP(EA), eV:	-10.48(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-methylidene-1,4-dioxaspiro[4.5]decan-8-yl)propan-2-one

Drug info:

PubChemData

Smile

C/C(=C\CCl)/C(Cl)(Cl)Cl

DOS

IR

Vibrations