Geometry & MOs

Info

ID:	440262
PubChem CID:	135230193
Reduced:	OSN7C18H19 (1)
Stoich.:	ABC7D18E19 (1)
Weight, g/mol:	558.160677
ΔH_f, kcal/mol:	124.47
Dipole, Da:	8.62
IP(EA), eV:	-8.95(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,4-N-bis(oxolan-2-yl)-1-N,4-N-bis(pyridin-2-ylmethyl)benzene-1,4-disulfonamide

Drug info:

PubChemData

Smile

CC1=CN=C(C(=C1OC)C)CSC2=NC3=CC=CC=C3N2C4=NN=NN4C

DOS

IR

Vibrations