Geometry & MOs

Info

ID:	375600
PubChem CID:	134214075
Reduced:	N5C11H15 (1)
Stoich.:	A5B11C15 (1)
Weight, g/mol:	360.986341
ΔH_f, kcal/mol:	47.7
Dipole, Da:	2.5
IP(EA), eV:	-9.03(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

[7-(2,2-difluoro-2-sulfoacetyl)oxy-6-tricyclo[3.2.1.02,4]octanyl] sulfite

Drug info:

PubChemData

Smile

CCCNC1=NC=NC(=C1)C2=CN=C(N2)C

DOS

IR

Vibrations