Geometry & MOs

Info

ID:	406156
PubChem CID:	135076726
Reduced:	NO3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	686.18725
ΔH_f, kcal/mol:	-84.3
Dipole, Da:	2.56
IP(EA), eV:	-10.08(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCOC(=O)OC(C=C)C1=CN=CC=C1

DOS

IR

Vibrations