Geometry & MOs

Info

ID:	29046
PubChem CID:	831315
Reduced:	FNO4H16C18 (1)
Stoich.:	ABC4D16E18 (1)
Weight, g/mol:	332.098334
ΔH_f, kcal/mol:	-155.36
Dipole, Da:	2.63
IP(EA), eV:	-9.43(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzo[e][1,3]benzothiazol-2-yl-1-(4-ethoxyphenyl)methanimine

Drug info:

PubChemData

Smile

C1COCCN1C(=O)C2=CC=CC=C2OC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations