Geometry & MOs

Info

ID:	426240
PubChem CID:	135142918
Reduced:	SO2N7C20H23 (1)
Stoich.:	AB2C7D20E23 (1)
Weight, g/mol:	304.074245
ΔH_f, kcal/mol:	24.8
Dipole, Da:	3.72
IP(EA), eV:	-8.93(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-(3,5,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-1,3,6,8,11-pentaen-4-ylmethyl)ethanesulfonamide

Drug info:

PubChemData

Smile

C1CC(CCC1CC#N)N2C(=NC3=CN=C4C(=C32)C=CN4)CNS(=O)(=O)CCC#N

DOS

IR

Vibrations