Geometry & MOs

Info

ID:	397151
PubChem CID:	135029809
Reduced:	OC10H14 (1)
Stoich.:	AB10C14 (1)
Weight, g/mol:	220.055801
ΔH_f, kcal/mol:	-38.49
Dipole, Da:	1.53
IP(EA), eV:	-8.73(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-6-thiophen-2-ylhex-4-en-2-ynoate

Drug info:

PubChemData

Smile

C1CC[C@@H]2C=C(C=C[C@@H]2C1)O

DOS

IR

Vibrations