Geometry & MOs

Info

ID:	243544
PubChem CID:	99226714
Reduced:	SN2O7H18C22 (1)
Stoich.:	AB2C7D18E22 (1)
Weight, g/mol:	374.090055
ΔH_f, kcal/mol:	-136.14
Dipole, Da:	7.28
IP(EA), eV:	-8.97(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-fluoro-4-methoxyphenyl)methyl]-2-(2-fluorophenyl)-N-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)NC2=CC=C(C=C2)OC(=O)C3=CC(=CC(=C3)S(=O)(=O)C)[N+](=O)[O-]

DOS

IR

Vibrations