Geometry & MOs

Info

ID:	303863
PubChem CID:	124490315
Reduced:	NO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	558.217302
ΔH_f, kcal/mol:	-174.64
Dipole, Da:	5.52
IP(EA), eV:	-9.29(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S,4S,5S,6R)-2-chloro-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxane

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)CCC(=O)O)C[C@@H](C(=O)O)N

DOS

IR

Vibrations