Geometry & MOs

Info

ID:	159663
PubChem CID:	57288598
Reduced:	NF3O3H17C19 (2)
Stoich.:	AB3C3D17E19 (2)
Weight, g/mol:	122.986438
ΔH_f, kcal/mol:	-447.22
Dipole, Da:	5.82
IP(EA), eV:	-9.51(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

carbamimidoyl sulfite

Drug info:

PubChemData

Smile

C1C(C(CN1CC2=CC=CC=C2)OC(=O)C(=O)OC3CN(CC3OC4=CC=CC(=C4)C(F)(F)F)CC5=CC=CC=C5)OC6=CC=CC(=C6)C(F)(F)F

DOS

IR

Vibrations