Geometry & MOs

Info

ID:	397863
PubChem CID:	135030855
Reduced:	SO3C17H20 (1)
Stoich.:	AB3C17D20 (1)
Weight, g/mol:	374.157682
ΔH_f, kcal/mol:	-95.82
Dipole, Da:	1.15
IP(EA), eV:	-7.88(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,6R)-4,5-diacetyloxy-2-(hydroxymethyl)-6-pent-4-enoxyoxan-3-yl] acetate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)SC2=C(C=C(C=C2OC)OC)OC)C

DOS

IR

Vibrations