Geometry & MOs

Info

ID:	68337
PubChem CID:	46508218
Reduced:	FO2N3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	426.107185
ΔH_f, kcal/mol:	-136.77
Dipole, Da:	4.13
IP(EA), eV:	-8.51(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,3-dimethylanilino)-2-oxoethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate

Drug info:

PubChemData

Smile

CC(C)CNC(=O)NC(=O)C(C)NC1=CC=C(C=C1)F

DOS

IR

Vibrations