Geometry & MOs

Info

ID:	407470
PubChem CID:	135080186
Reduced:	O4C7H14 (1)
Stoich.:	A4B7C14 (1)
Weight, g/mol:	124.088815
ΔH_f, kcal/mol:	-199.55
Dipole, Da:	0.85
IP(EA), eV:	-10.55(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@H](CO)O

DOS

IR

Vibrations