Geometry & MOs

Info

ID:	214989
PubChem CID:	85083964
Reduced:	PN2O11C32H43 (1)
Stoich.:	AB2C11D32E43 (1)
Weight, g/mol:	662.269125
ΔH_f, kcal/mol:	-491.44
Dipole, Da:	4.98
IP(EA), eV:	-9.33(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2,2-difluoro-2-[2-hydroxy-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]acetate

Drug info:

PubChemData

Smile

CCOP(=O)(C(C(=O)OCC1=CC=CC=C1)N2C(C(C2=O)NC(CO)C3=CC=CC=C3)CCC4(OCCO4)COC(=O)C)OCC

DOS

IR

Vibrations