Geometry & MOs

Info

ID:	338716
PubChem CID:	127259727
Reduced:	NC27H27 (1)
Stoich.:	AB27C27 (1)
Weight, g/mol:	293.098669
ΔH_f, kcal/mol:	74.57
Dipole, Da:	3.67
IP(EA), eV:	-7.85(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-2-[4-(4-aminophenyl)-1,3-thiazol-2-yl]ethenyl]aniline

Drug info:

PubChemData

Smile

CCN(CC)C1=CC(=C(C=C1)/C=C/C2=C3C=CC=CC3=CC4=CC=CC=C42)C

DOS

IR

Vibrations