Geometry & MOs

Info

ID:	20256
PubChem CID:	582818
Reduced:	N2O4H14C17 (1)
Stoich.:	A2B4C14D17 (1)
Weight, g/mol:	310.095357
ΔH_f, kcal/mol:	-8.17
Dipole, Da:	7.06
IP(EA), eV:	-9.47(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[3-(4-nitrophenyl)iminoprop-1-enyl]phenyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=CC=C1C=CC=NC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations