Geometry & MOs

Info

ID:	343074
PubChem CID:	127266247
Reduced:	SO3N4C15H26 (1)
Stoich.:	AB3C4D15E26 (1)
Weight, g/mol:	308.130697
ΔH_f, kcal/mol:	-117.7
Dipole, Da:	5.28
IP(EA), eV:	-8.34(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-[3-(4-methyl-1,2,4-triazol-3-yl)propyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCN1CC(N(C(C1)C)S(=O)(=O)C2=CN(C(=C2)C(=O)NC)C)C

DOS

IR

Vibrations