Geometry & MOs

Info

ID:	386304
PubChem CID:	134981328
Reduced:	NO3C15H15 (1)
Stoich.:	AB3C15D15 (1)
Weight, g/mol:	211.988363
ΔH_f, kcal/mol:	-57.21
Dipole, Da:	3.33
IP(EA), eV:	-10.17(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCOC(=O)C(CC(=C)C(=O)C1=CC=CC=C1)C#N

DOS

IR

Vibrations