Geometry & MOs

Info

ID:	425444
PubChem CID:	135126355
Reduced:	NOH7C9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	571.517574
ΔH_f, kcal/mol:	8.1
Dipole, Da:	3.52
IP(EA), eV:	-9.13(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R,4S,5R,6R)-6-(aminomethyl)-3,4-di(tetradecoxy)oxane-2,5-diol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3=NC=C(C=C3)O

DOS

IR

Vibrations