Geometry & MOs

Info

ID:	286645
PubChem CID:	104179599
Reduced:	ClSN2C15H17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	272.13472
ΔH_f, kcal/mol:	44.31
Dipole, Da:	3.02
IP(EA), eV:	-9.34(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methylphenyl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine

Drug info:

PubChemData

Smile

CC1=CN=C(S1)CNC2CC(C2)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations