Geometry & MOs

Info

ID:	217220
PubChem CID:	85087455
Reduced:	OPH21C23 (1)
Stoich.:	ABC21D23 (1)
Weight, g/mol:	344.198759
ΔH_f, kcal/mol:	25.41
Dipole, Da:	4.9
IP(EA), eV:	-8.68(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(5-phenylmethoxypent-3-enyl)-1,4-dioxaspiro[4.5]decane-8-carbaldehyde

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CC=CCP(=O)(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations