Geometry & MOs

Info

ID:	399001
PubChem CID:	135036884
Reduced:	O5C13H22 (1)
Stoich.:	A5B13C22 (1)
Weight, g/mol:	255.085521
ΔH_f, kcal/mol:	-233.47
Dipole, Da:	2.44
IP(EA), eV:	-10.07(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-acetyloxy-4-azido-3,4-dihydro-2H-pyran-2-yl)methyl acetate

Drug info:

PubChemData

Smile

CC1(O[C@H]2[C@@H](O1)O[C@H](C2=C)COC(C)(C)OC)C

DOS

IR

Vibrations