Geometry & MOs

Info

ID:	159519
PubChem CID:	57288351
Reduced:	NO4H13C16 (1)
Stoich.:	AB4C13D16 (1)
Weight, g/mol:	286.076057
ΔH_f, kcal/mol:	-23.74
Dipole, Da:	7.43
IP(EA), eV:	-9.96(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-2-phenylbut-3-enoxy)benzaldehyde

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=C(COC(=O)C2=CC=CC=C2)[N+](=O)[O-]

DOS

IR

Vibrations