Geometry & MOs

Info

ID:	265316
PubChem CID:	103516910
Reduced:	F2N2C11H16 (1)
Stoich.:	A2B2C11D16 (1)
Weight, g/mol:	270.100226
ΔH_f, kcal/mol:	-88.82
Dipole, Da:	4.68
IP(EA), eV:	-9.09(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-benzothiazol-2-yl)-1,1-difluoro-N-propylpropan-2-amine

Drug info:

PubChemData

Smile

CCC1=CN=C(C=C1)CC(C(F)F)NC

DOS

IR

Vibrations