Geometry & MOs

Info

ID:	443329
PubChem CID:	135258600
Reduced:	FON6C21H21 (1)
Stoich.:	ABC6D21E21 (1)
Weight, g/mol:	404.268845
ΔH_f, kcal/mol:	59.33
Dipole, Da:	6.13
IP(EA), eV:	-8.48(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(1-methyl-2,3-dihydro-1,5-naphthyridin-4-ylidene)amino]-1-[4-(4-propan-2-ylphenyl)piperazin-1-yl]ethenamine

Drug info:

PubChemData

Smile

C=C(N/N=C\1/CCOC2=C(C=CN=C12)F)N3CCN(CC3)C4=CC=C(C=C4)C#N

DOS

IR

Vibrations