Geometry & MOs

Info

ID:	381819
PubChem CID:	134972654
Reduced:	NO2C20H25 (1)
Stoich.:	AB2C20D25 (1)
Weight, g/mol:	479.07059
ΔH_f, kcal/mol:	-61.72
Dipole, Da:	2.13
IP(EA), eV:	-8.32(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azido-3-iodo-5-phenylmethoxy-6-(phenylmethoxymethyl)oxane

Drug info:

PubChemData

Smile

CC([C@]1(CC[C@H]([C@@H](C1=O)C2=CNC3=CC=CC=C32)C(=C)C)C)O

DOS

IR

Vibrations