Geometry & MOs

Info

ID:	200984
PubChem CID:	79470262
Reduced:	SO2N3C10H19 (1)
Stoich.:	AB2C3D10E19 (1)
Weight, g/mol:	244.157563
ΔH_f, kcal/mol:	-71.59
Dipole, Da:	3.66
IP(EA), eV:	-9.55(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyano-N-ethyl-N-(2-methylbutyl)benzamide

Drug info:

PubChemData

Smile

CCC(C)CN(CC)S(=O)(=O)C1=CN=CN1

DOS

IR

Vibrations