Geometry & MOs

Info

ID:	324070
PubChem CID:	126676874
Reduced:	F2N7H13C20 (1)
Stoich.:	A2B7C13D20 (1)
Weight, g/mol:	360.05371
ΔH_f, kcal/mol:	76.81
Dipole, Da:	4.41
IP(EA), eV:	-9.01(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(Z)-1-ethylsulfanyl-2-(methylideneamino)prop-1-enyl]-1,3-thiazol-2-yl]-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)C(F)F)C2=NN3C=CC=C3C(=N2)NC4=C5C(=NC=C4)C=CC=N5

DOS

IR

Vibrations