Geometry & MOs

Info

ID:	396357
PubChem CID:	135028204
Reduced:	NO2C7H11 (2)
Stoich.:	AB2C7D11 (2)
Weight, g/mol:	586.347837
ΔH_f, kcal/mol:	-144.55
Dipole, Da:	2.43
IP(EA), eV:	-8.99(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl-[(2R,3R,4R)-4-[(1S,3R,4R)-1,4-dimethyl-2,8-dioxabicyclo[3.2.1]octan-3-yl]-2-methyl-3-phenylmethoxypentoxy]-diphenylsilane

Drug info:

PubChemData

Smile

CC1(O[C@@H]2[C@@H]3CC=NC(C2O1)N3C(=O)OC(C)(C)C)C

DOS

IR

Vibrations