Geometry & MOs

Info

ID:	272161
PubChem CID:	103729862
Reduced:	SN2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	296.13472
ΔH_f, kcal/mol:	31.76
Dipole, Da:	1.15
IP(EA), eV:	-9.22(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-naphthalen-2-ylethanamine

Drug info:

PubChemData

Smile

CC1=CN=C(S1)CNC(CC(C)C)C2=CC=CC=C2

DOS

IR

Vibrations