Geometry & MOs

Info

ID:	231505
PubChem CID:	87573950
Reduced:	F2S2O4N7H21C26 (1)
Stoich.:	A2B2C4D7E21F26 (1)
Weight, g/mol:	283.136561
ΔH_f, kcal/mol:	48.96
Dipole, Da:	10.53
IP(EA), eV:	-9.32(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=NN=C(S1)N2C(SC(=N2)C3=C(C=CC(=C3)F)F)(CCC(C4=CC(=CC=C4)[N+](=O)[O-])N)C5=CC(=CC=C5)[N+](=O)[O-]

DOS

IR

Vibrations