Geometry & MOs

Info

ID:	286620
PubChem CID:	104179512
Reduced:	ClNSC16H22 (1)
Stoich.:	ABCD16E22 (1)
Weight, g/mol:	279.145699
ΔH_f, kcal/mol:	4.06
Dipole, Da:	3.4
IP(EA), eV:	-8.48(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-fluorophenyl)-N-(thian-4-ylmethyl)cyclobutan-1-amine

Drug info:

PubChemData

Smile

C1CSCCC1CNC2CC(C2)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations