Geometry & MOs

Info

ID:	320261
PubChem CID:	126659073
Reduced:	NS2F3O4C19H24 (1)
Stoich.:	AB2C3D4E19F24 (1)
Weight, g/mol:	198.91303
ΔH_f, kcal/mol:	-292.16
Dipole, Da:	6.99
IP(EA), eV:	-9.23(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-iodo-2-nitroethene

Drug info:

PubChemData

Smile

C1CC(=O)C([C@H]1CCC[C@H](CCC(=C(F)F)F)O)CCSC2=NC(=CS2)C(=O)O

DOS

IR

Vibrations