Geometry & MOs

Info

ID:	399637
PubChem CID:	135041399
Reduced:	NSF3O3H6C10 (1)
Stoich.:	ABC3D3E6F10 (1)
Weight, g/mol:	258.16198
ΔH_f, kcal/mol:	-209.68
Dipole, Da:	3.73
IP(EA), eV:	-9.6(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-methylcyclohexen-1-yl)methyl]-2-phenyl-1,3-dioxolane

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2S(=O)(=O)C(F)(F)F)C=O

DOS

IR

Vibrations