Geometry & MOs

Info

ID:	388126
PubChem CID:	134988262
Reduced:	NO5C9H13 (1)
Stoich.:	AB5C9D13 (1)
Weight, g/mol:	251.055879
ΔH_f, kcal/mol:	-209.42
Dipole, Da:	5.22
IP(EA), eV:	-10.69(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCOC(=O)CC[C@@H](C(=O)OC)N=C=O

DOS

IR

Vibrations