Geometry & MOs

Info

ID:	259536
PubChem CID:	103167599
Reduced:	ClN3C14H16 (1)
Stoich.:	AB3C14D16 (1)
Weight, g/mol:	244.099397
ΔH_f, kcal/mol:	60.42
Dipole, Da:	6.31
IP(EA), eV:	-9.82(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyclobutylmethyl)-4-ethyl-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

C1CC(C1)CC2=NN=C(N2C3=CC=CC=C3)CCl

DOS

IR

Vibrations