Geometry & MOs

Info

ID:	206852
PubChem CID:	80309632
Reduced:	OSN3C13H13 (1)
Stoich.:	ABC3D13E13 (1)
Weight, g/mol:	270.082684
ΔH_f, kcal/mol:	36.48
Dipole, Da:	5.89
IP(EA), eV:	-8.8(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-methyl-1,3-thiazol-2-yl)methoxy]naphthalen-1-amine

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)COC2=C(C=C(C=C2)N)C#N)C

DOS

IR

Vibrations