Geometry & MOs

Info

ID:	286641
PubChem CID:	104179595
Reduced:	SN2C15H18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	276.109648
ΔH_f, kcal/mol:	55.34
Dipole, Da:	1.23
IP(EA), eV:	-9.2(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-fluorophenyl)-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

DOS

IR

Vibrations