Geometry & MOs

Info

ID:	328902
PubChem CID:	126729002
Reduced:	O2F9C17H25 (1)
Stoich.:	A2B9C17D25 (1)
Weight, g/mol:	216.136159
ΔH_f, kcal/mol:	-606.52
Dipole, Da:	4.39
IP(EA), eV:	-10.89(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(2S,4S)-4-hydroxyoxolan-2-yl]propanoate

Drug info:

PubChemData

Smile

CC(C)(C)CC(C(=O)OCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C)(C)C

DOS

IR

Vibrations