Geometry & MOs

Info

ID:	45331
PubChem CID:	10511344
Reduced:	N2O3C7H10 (1)
Stoich.:	A2B3C7D10 (1)
Weight, g/mol:	170.094294
ΔH_f, kcal/mol:	-88.45
Dipole, Da:	1.98
IP(EA), eV:	-9.13(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,6R)-2,6-dimethyl-3,6-dihydro-2H-pyran-3-yl] acetate

Drug info:

PubChemData

Smile

C1[C@@H]2[C@H]1C(=O)N(NC2=O)CCO

DOS

IR

Vibrations