Geometry & MOs

Info

ID:	30154
PubChem CID:	840335
Reduced:	ClON2H9C11 (1)
Stoich.:	ABC2D9E11 (1)
Weight, g/mol:	308.098334
ΔH_f, kcal/mol:	25.71
Dipole, Da:	2.66
IP(EA), eV:	-9.3(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-N-(4-phenyl-1,3-thiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC=N1)Cl)OC2=CC=CC=C2

DOS

IR

Vibrations