Geometry & MOs

Info

ID:	437837
PubChem CID:	135227123
Reduced:	FIOSN2H12C15 (1)
Stoich.:	ABCDE2F12G15 (1)
Weight, g/mol:	577.07185
ΔH_f, kcal/mol:	-8.33
Dipole, Da:	1.69
IP(EA), eV:	-8.37(-2.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[5-cyclopropylsulfanyl-2-(spiro[2.5]octan-6-ylamino)phenyl]-6-methyl-7-oxopyrrolo[2,3-c]pyridin-1-yl] thiohypoiodite

Drug info:

PubChemData

Smile

CN1C=C(C2=C(C1=O)N(C=C2)I)C3=C(C=CC(=C3)SC)F

DOS

IR

Vibrations