Geometry & MOs

Info

ID:	216771
PubChem CID:	85086749
Reduced:	ON2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	300.193674
ΔH_f, kcal/mol:	71.69
Dipole, Da:	8.96
IP(EA), eV:	-8.31(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2,2-dimethyl-6-(3-methylbut-2-enoxy)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]butan-1-ol

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=C(ON=[N+]2CCC3=CC=CC=C3)N=N[O-]

DOS

IR

Vibrations