Geometry & MOs

Info

ID:	405351
PubChem CID:	135073578
Reduced:	OC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	272.087101
ΔH_f, kcal/mol:	-42.91
Dipole, Da:	2.43
IP(EA), eV:	-8.77(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-(1-ethoxyethoxy)phenyl]ethynyl]thiophene

Drug info:

PubChemData

Smile

CCCCC#CC1=CC=CC=C1OC(C)OCC

DOS

IR

Vibrations