Geometry & MOs

Info

ID:	269537
PubChem CID:	103617907
Reduced:	SO2N3C15H15 (1)
Stoich.:	AB2C3D15E15 (1)
Weight, g/mol:	224.188863
ΔH_f, kcal/mol:	-45.3
Dipole, Da:	3.86
IP(EA), eV:	-9.14(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-(2-ethylhexyl)-2-methylpropanamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CNC(=O)C2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations