Geometry & MOs

Info

ID:	19850
PubChem CID:	574100
Reduced:	OSC9H12 (1)
Stoich.:	ABC9D12 (1)
Weight, g/mol:	168.060886
ΔH_f, kcal/mol:	-26.77
Dipole, Da:	2.98
IP(EA), eV:	-9.41(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-thiophen-2-ylpentan-1-one

Drug info:

PubChemData

Smile

CCCCC(=O)C1=CC=CS1

DOS

IR

Vibrations