Geometry & MOs

Info

ID:	312485
PubChem CID:	126605734
Reduced:	FOSN4C10H11 (1)
Stoich.:	ABCD4E10F11 (1)
Weight, g/mol:	418.077886
ΔH_f, kcal/mol:	-22.25
Dipole, Da:	4.42
IP(EA), eV:	-9.59(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-chloro-2-(methylamino)benzenecarboximidoyl]-7-(2-methylaziridine-1-carbonyl)pyrrolo[2,3-b]pyrazin-5-yl] thiohypofluorite

Drug info:

PubChemData

Smile

CCNC(=O)C1=CN(C2=NC=C(N=C12)C)SF

DOS

IR

Vibrations