Geometry & MOs

Info

ID:	224662
PubChem CID:	85345787
Reduced:	O5C18H28 (1)
Stoich.:	A5B18C28 (1)
Weight, g/mol:	324.193674
ΔH_f, kcal/mol:	-261.69
Dipole, Da:	5.68
IP(EA), eV:	-9.85(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(2,2-dimethylpropanoyloxymethyl)-3,4-dimethylideneoxolan-2-yl]methyl 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC1(COC2(CCC(=O)C3C2CC4C(C3)OC(O4)(C)C)OC1)C

DOS

IR

Vibrations