Geometry & MOs

Info

ID:	257917
PubChem CID:	103149177
Reduced:	NOF2C11H19 (1)
Stoich.:	ABC2D11E19 (1)
Weight, g/mol:	300.110791
ΔH_f, kcal/mol:	-132.78
Dipole, Da:	3.78
IP(EA), eV:	-8.9(1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzothiazol-2-yl)-4-(2,2-difluoroethoxy)-N-methylbutan-2-amine

Drug info:

PubChemData

Smile

CC#CCCC(CCOCC(F)F)NC

DOS

IR

Vibrations