Geometry & MOs

Info

ID:	60527
PubChem CID:	26697135
Reduced:	FN2S2O3C19H23 (1)
Stoich.:	AB2C2D3E19F23 (1)
Weight, g/mol:	309.172879
ΔH_f, kcal/mol:	-139.39
Dipole, Da:	5.8
IP(EA), eV:	-8.41(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,4-bis(4-ethylphenyl)-4-oxobutanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)[C@@H](CCSC)NS(=O)(=O)C2=CC=CC=C2F

DOS

IR

Vibrations