Geometry & MOs

Info

ID:	10330
PubChem CID:	100502
Reduced:	NH8C12 (2)
Stoich.:	AB8C12 (2)
Weight, g/mol:	332.131349
ΔH_f, kcal/mol:	230.66
Dipole, Da:	1.34
IP(EA), eV:	-9.08(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-ethynylphenyl)-1-[4-[(3-ethynylphenyl)iminomethyl]phenyl]methanimine

Drug info:

PubChemData

Smile

C#CC1=CC(=CC=C1)N=CC2=CC=C(C=C2)C=NC3=CC=CC(=C3)C#C

DOS

IR

Vibrations