Geometry & MOs

Info

ID:	38324
PubChem CID:	8030461
Reduced:	FSO2N4H11C16 (1)
Stoich.:	ABC2D4E11F16 (1)
Weight, g/mol:	192.137497
ΔH_f, kcal/mol:	53.03
Dipole, Da:	6.76
IP(EA), eV:	-9.13(-1.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[[(2R)-2-cyanobutan-2-yl]diazenyl]-2-methylbutanenitrile

Drug info:

PubChemData

Smile

C1=COC(=C1)/C=C/C2=NN3C(=NN=C3S2)COC4=CC=C(C=C4)F

DOS

IR

Vibrations