Geometry & MOs

Info

ID:	48123
PubChem CID:	10537322
Reduced:	OC3H5 (4)
Stoich.:	AB3C5 (4)
Weight, g/mol:	228.136159
ΔH_f, kcal/mol:	-194.09
Dipole, Da:	4.43
IP(EA), eV:	-10.4(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1S,3R)-2,2-dimethyl-3-(2-methyl-1,3-dioxolan-2-yl)cyclobutane-1-carboxylate

Drug info:

PubChemData

Smile

CCCCC/C=C\1/CC(OC1=O)(CO)CO

DOS

IR

Vibrations