Geometry & MOs

Info

ID:	320897
PubChem CID:	126664211
Reduced:	N5C10H11 (1)
Stoich.:	A5B10C11 (1)
Weight, g/mol:	507.020419
ΔH_f, kcal/mol:	121.99
Dipole, Da:	7.66
IP(EA), eV:	-9.17(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(2-hydroxyethoxy)-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]-2-[4-(trifluoromethylsulfonyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)C#CNC1=NC2=NC=NC=C2N1

DOS

IR

Vibrations