Geometry & MOs

Info

ID:	47124
PubChem CID:	10529741
Reduced:	N3O5C29H41 (1)
Stoich.:	A3B5C29D41 (1)
Weight, g/mol:	512.235145
ΔH_f, kcal/mol:	-235.23
Dipole, Da:	6.41
IP(EA), eV:	-9.74(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,1S,2R,3R)-1,5-diphenyl-3-trityloxypent-4-ene-1,2-diol

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NC(=O)C[C@@H]([C@H](C(C)(C)C)NC(=O)OC(C)(C)C)NC(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations