Geometry & MOs

Info

ID:	396654
PubChem CID:	135028989
Reduced:	INOSF3H3C8 (1)
Stoich.:	ABCDE3F3G8 (1)
Weight, g/mol:	143.154824
ΔH_f, kcal/mol:	-86.4
Dipole, Da:	5.31
IP(EA), eV:	-9.64(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(E)-3-(dimethylamino)but-2-enyl]-dimethylazanium

Drug info:

PubChemData

Smile

C1=CSC(=C1)C2=C(C(=NO2)C(F)(F)F)I

DOS

IR

Vibrations