Geometry & MOs

Info

ID:	139672
PubChem CID:	52577312
Reduced:	SN2O2H20C23 (1)
Stoich.:	AB2C2D20E23 (1)
Weight, g/mol:	443.131506
ΔH_f, kcal/mol:	3.65
Dipole, Da:	1.4
IP(EA), eV:	-8.74(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethoxyphenyl)-N'-[(2S)-2-(2-fluorophenoxy)propanoyl]-4-methyl-1,3-thiazole-5-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4COC

DOS

IR

Vibrations