Geometry & MOs

Info

ID:	443865
PubChem CID:	135260226
Reduced:	F2O3N5H21C25 (1)
Stoich.:	A2B3C5D21E25 (1)
Weight, g/mol:	156.996427
ΔH_f, kcal/mol:	-129.48
Dipole, Da:	5.77
IP(EA), eV:	-8.82(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,1-dioxothietan-3-yl)azanium;chloride

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(C=C(C(=C3)CN4C5=CC=CC=C5C(=O)NC4=O)F)F

DOS

IR

Vibrations