Geometry & MOs

Info

ID:	78846
PubChem CID:	49737922
Reduced:	OSN4C19H20 (1)
Stoich.:	ABC4D19E20 (1)
Weight, g/mol:	342.09506
ΔH_f, kcal/mol:	21.89
Dipole, Da:	3.76
IP(EA), eV:	-8.57(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluorophenyl)-2-[2-[(4-methylpyridin-2-yl)amino]-1,3-thiazol-4-yl]acetamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC3=NC=CC(=C3)C

DOS

IR

Vibrations