Geometry & MOs

Info

ID:	412622
PubChem CID:	135085519
Reduced:	AgO4C11H15 (1)
Stoich.:	AB4C11D15 (1)
Weight, g/mol:	212.104859
ΔH_f, kcal/mol:	-160.34
Dipole, Da:	3.19
IP(EA), eV:	-8.39(-4.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4S)-4-acetyloxy-4-methylhex-5-yn-3-yl] acetate

Drug info:

PubChemData

Smile

CC[C@H]([C@](C)(C#[C-])OC(=O)C)OC(=O)C.[Ag+]

DOS

IR

Vibrations