Geometry & MOs

Info

ID:	221876
PubChem CID:	85291517
Reduced:	NSO2C15H19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	278.082409
ΔH_f, kcal/mol:	-48.1
Dipole, Da:	6.03
IP(EA), eV:	-9.06(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methoxy-2,2-dimethyl-4-methylidene-3a,5,6,6a-tetrahydrocyclopenta[d][1,3]dioxol-5-yl) methanesulfonate

Drug info:

PubChemData

Smile

CC=C1CCN(CC1=C)S(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations