Geometry & MOs

Info

ID:	234550
PubChem CID:	92298671
Reduced:	N2F3O3H19C22 (1)
Stoich.:	A2B3C3D19E22 (1)
Weight, g/mol:	290.112738
ΔH_f, kcal/mol:	-187.88
Dipole, Da:	7.68
IP(EA), eV:	-9.82(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N'-[(1,3-dioxo-3a,4,5,6,7,7a-hexahydroinden-2-ylidene)amino]-1,2,5-oxadiazole-3-carboximidamide

Drug info:

PubChemData

Smile

C1CN2[C@H](CC(=O)[C@@H](C2=O)/C=N/OCC3=CC=C(C=C3)C(F)(F)F)C4=CC=CC=C41

DOS

IR

Vibrations