Geometry & MOs

Info

ID:	286618
PubChem CID:	104179506
Reduced:	NOC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	279.145699
ΔH_f, kcal/mol:	-53.6
Dipole, Da:	2.27
IP(EA), eV:	-8.81(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC(C)(CNC1CC(C1)C2=CC=CC=C2C)O

DOS

IR

Vibrations