Geometry & MOs

Info

ID:	16167
PubChem CID:	460642
Reduced:	NSH13C14 (1)
Stoich.:	ABC13D14 (1)
Weight, g/mol:	227.076871
ΔH_f, kcal/mol:	52.1
Dipole, Da:	0.98
IP(EA), eV:	-8.78(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(naphthalen-1-ylmethyl)-4,5-dihydro-1,3-thiazole

Drug info:

PubChemData

Smile

C1CSC(=N1)CC2=CC=CC3=CC=CC=C32

DOS

IR

Vibrations