Geometry & MOs

Info

ID:	383293
PubChem CID:	134974930
Reduced:	O2C17H26 (1)
Stoich.:	A2B17C26 (1)
Weight, g/mol:	374.230453
ΔH_f, kcal/mol:	-83.7
Dipole, Da:	0.99
IP(EA), eV:	-9.36(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[(6R)-6-butyl-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,3-dihydroxyoxan-2-yl]propanoate

Drug info:

PubChemData

Smile

CC(C)C[C@H](C[C@@H](CC=C)O)OCC1=CC=CC=C1

DOS

IR

Vibrations