Geometry & MOs

Info

ID:	172809
PubChem CID:	75555715
Reduced:	O2N4H14C17 (1)
Stoich.:	A2B4C14D17 (1)
Weight, g/mol:	272.041962
ΔH_f, kcal/mol:	34.82
Dipole, Da:	11.32
IP(EA), eV:	-8.6(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(6-fluoro-1,3-benzothiazol-2-yl)phenyl]methylidene]hydroxylamine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=C3C=C(C=C(C3=O)C)N4C=NN=C4)N2

DOS

IR

Vibrations