Geometry & MOs

Info

ID:	396996
PubChem CID:	135029564
Reduced:	NOC14H23 (1)
Stoich.:	ABC14D23 (1)
Weight, g/mol:	333.168856
ΔH_f, kcal/mol:	-33.04
Dipole, Da:	5.58
IP(EA), eV:	-9.82(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-5-[(1R)-1-azido-5-[(4-methoxyphenyl)methoxy]pentyl]oxolan-2-one

Drug info:

PubChemData

Smile

CC/C=C\CCCCCC(C)(/C=C/C#N)O

DOS

IR

Vibrations