Geometry & MOs

Info

ID:	131445
PubChem CID:	51206269
Reduced:	SO2N4C18H22 (1)
Stoich.:	AB2C4D18E22 (1)
Weight, g/mol:	337.124883
ΔH_f, kcal/mol:	-48.88
Dipole, Da:	3.67
IP(EA), eV:	-8.78(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-propan-2-ylphenyl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=CC(=C2)C(=O)NC

DOS

IR

Vibrations