Geometry & MOs

Info

ID:	394349
PubChem CID:	135022799
Reduced:	NO8C34H39 (1)
Stoich.:	AB8C34D39 (1)
Weight, g/mol:	491.230788
ΔH_f, kcal/mol:	-282.68
Dipole, Da:	3.74
IP(EA), eV:	-9.34(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,4R,5S)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]methyl carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C(=O)OC[C@@]12C[C@H]([C@@H](C(O2)COCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

DOS

IR

Vibrations