Geometry & MOs

Info

ID:	20835
PubChem CID:	586041
Reduced:	ClNO5H14C16 (1)
Stoich.:	ABC5D14E16 (1)
Weight, g/mol:	335.05605
ΔH_f, kcal/mol:	-71.65
Dipole, Da:	5.66
IP(EA), eV:	-9.06(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-5-ethoxy-4-[(3-nitrophenyl)methoxy]benzaldehyde

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)C=O)Cl)OCC2=CC(=CC=C2)[N+](=O)[O-]

DOS

IR

Vibrations