Geometry & MOs

Info

ID:	188425
PubChem CID:	77716341
Reduced:	SO6N8C30H44 (1)
Stoich.:	AB6C8D30E44 (1)
Weight, g/mol:	270.046299
ΔH_f, kcal/mol:	-162.21
Dipole, Da:	2.73
IP(EA), eV:	-8.4(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-naphthalen-1-ylsulfonylpyridazine

Drug info:

PubChemData

Smile

CCCC1=C2C(C(=O)NC(N2)C3=C(N=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)OC(CCOC)OC)NN1CC5=CC=CC=N5

DOS

IR

Vibrations