Geometry & MOs

Info

ID:	436985
PubChem CID:	135213519
Reduced:	Cl2N2S2O4C9H12 (1)
Stoich.:	A2B2C2D4E9F12 (1)
Weight, g/mol:	262.204513
ΔH_f, kcal/mol:	-146.95
Dipole, Da:	2.17
IP(EA), eV:	-10.21(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(diethylamino)-N-ethyl-N-phenylbutanamide

Drug info:

PubChemData

Smile

CCCNS(=O)(=O)C1=CC(=C(C(=C1)Cl)Cl)S(=O)(=O)N

DOS

IR

Vibrations