Geometry & MOs

Info

ID:	438302
PubChem CID:	135228034
Reduced:	N7H21C23 (1)
Stoich.:	A7B21C23 (1)
Weight, g/mol:	246.153227
ΔH_f, kcal/mol:	162.68
Dipole, Da:	4.71
IP(EA), eV:	-8.98(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,4E,6E)-5-fluoro-2-methyl-1-(5-methylpyridin-2-yl)octa-2,4,6-trien-1-amine

Drug info:

PubChemData

Smile

CC1=C(N(N=N1)C)C2=CC3=C(C=C2)N=C(N3C(C4=CC=CC=N4)C5=CC=CC=N5)C

DOS

IR

Vibrations