Geometry & MOs

Info

ID:	319887
PubChem CID:	126657469
Reduced:	OPC7H9 (1)
Stoich.:	ABC7D9 (1)
Weight, g/mol:	585.278526
ΔH_f, kcal/mol:	-28.45
Dipole, Da:	2.2
IP(EA), eV:	-8.62(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-5-(acetyloxymethoxycarbonylamino)-6-[(2S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexan-3-yl] 6-phenylhexanoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)P)O

DOS

IR

Vibrations