Geometry & MOs

Info

ID:	168160
PubChem CID:	74930523
Reduced:	ClO2S2N4H15C20 (1)
Stoich.:	AB2C2D4E15F20 (1)
Weight, g/mol:	240.136159
ΔH_f, kcal/mol:	45.55
Dipole, Da:	3.12
IP(EA), eV:	-9.16(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3a-cyclohexyl-2,2-dimethyl-4,6a-dihydrofuro[3,4-d][1,3]dioxol-6-one

Drug info:

PubChemData

Smile

C1=CC(=CC2=NC(=S)N(C(=O)C21)CC3=NC=CS3)C(=O)NCC4=CC=C(C=C4)Cl

DOS

IR

Vibrations