Geometry & MOs

Info

ID:	410236
PubChem CID:	135083027
Reduced:	SSnN2F3O4C20H21 (1)
Stoich.:	ABC2D3E4F20G21 (1)
Weight, g/mol:	558.152491
ΔH_f, kcal/mol:	-256.63
Dipole, Da:	6.3
IP(EA), eV:	-9.02(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2S,3S,4R)-2-(diphenylphosphorylmethyl)-4-(2-hydroxyphenoxy)oxan-3-ol;propan-2-ol;titanium;cyanide

Drug info:

PubChemData

Smile

C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@H](C3=CC=NC4=CC=CC=C34)O[Sn]OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations