Geometry & MOs

Info

ID:	315410
PubChem CID:	126626054
Reduced:	O2C17H30 (1)
Stoich.:	A2B17C30 (1)
Weight, g/mol:	172.038043
ΔH_f, kcal/mol:	-122.71
Dipole, Da:	2.23
IP(EA), eV:	-9.35(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-ethylsulfanylethyl)thiophene

Drug info:

PubChemData

Smile

CCC(C(C)C)OC(=O)CCC(=C=CC(C)(C)C)C

DOS

IR

Vibrations