Geometry & MOs

Info

ID:	392673
PubChem CID:	135017567
Reduced:	NO2C20H23 (1)
Stoich.:	AB2C20D23 (1)
Weight, g/mol:	326.209324
ΔH_f, kcal/mol:	-51.97
Dipole, Da:	1.25
IP(EA), eV:	-8.8(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S,4S,5S,6S)-7-[(4-methoxyphenyl)methoxy]-2,4,6-trimethylheptane-1,3,5-triol

Drug info:

PubChemData

Smile

C/C=C(\C1=CC=CC=C1)/N(C2=CC=CC=C2)C(=O)OC(C)(C)C

DOS

IR

Vibrations