Geometry & MOs

Info

ID:	349490
PubChem CID:	127275277
Reduced:	SO3N5C17H29 (1)
Stoich.:	AB3C5D17E29 (1)
Weight, g/mol:	311.166748
ΔH_f, kcal/mol:	-97.39
Dipole, Da:	10.02
IP(EA), eV:	-8.84(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-1-ethylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)S(=O)(=O)N2CCN(CC2)CC(=O)N3CCCCCC3

DOS

IR

Vibrations