Geometry & MOs

Info

ID:	44625
PubChem CID:	10504532
Reduced:	NSiO5C26H35 (1)
Stoich.:	ABC5D26E35 (1)
Weight, g/mol:	469.153407
ΔH_f, kcal/mol:	-241.4
Dipole, Da:	3.28
IP(EA), eV:	-8.42(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-1-benzyl-2-[bis(phenylsulfanyl)methyl]-3-phenoxyazetidine

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC1=C(C=CC(=C1)CCC(=O)N2[C@H](COC2=O)CC3=CC=CC=C3)OC

DOS

IR

Vibrations