Geometry & MOs

Info

ID:	403704
PubChem CID:	135061484
Reduced:	ClNC19H28 (1)
Stoich.:	ABC19D28 (1)
Weight, g/mol:	345.136493
ΔH_f, kcal/mol:	-20.74
Dipole, Da:	4.0
IP(EA), eV:	-7.83(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-nitro-4-[2-phenyl-2-(1-phenylethoxy)ethenyl]benzene

Drug info:

PubChemData

Smile

CCCCC1=CC(N(C2=C1C=C(C=C2)Cl)C)(CC)CCC

DOS

IR

Vibrations