Geometry & MOs

Info

ID:	220751
PubChem CID:	85230863
Reduced:	OC16H22 (1)
Stoich.:	AB16C22 (1)
Weight, g/mol:	160.034671
ΔH_f, kcal/mol:	-41.77
Dipole, Da:	3.52
IP(EA), eV:	-9.19(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hexa-3,5-dien-1-ynylthiophene

Drug info:

PubChemData

Smile

CCCCC(=C(CC1=CC=CC=C1)C(=O)C)C

DOS

IR

Vibrations