Geometry & MOs

Info

ID:	319005
PubChem CID:	126654105
Reduced:	N2O8C15H22 (1)
Stoich.:	A2B8C15D22 (1)
Weight, g/mol:	157.085127
ΔH_f, kcal/mol:	-334.87
Dipole, Da:	5.77
IP(EA), eV:	-9.94(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-azido-5-hydroxyhexan-3-one

Drug info:

PubChemData

Smile

COC(=O)CC(COCC(CNC(=O)CCN1C(=O)C=CC1=O)O)O

DOS

IR

Vibrations