Geometry & MOs

Info

ID:	406161
PubChem CID:	135076731
Reduced:	SCl4H10C12 (1)
Stoich.:	AB4C10D12 (1)
Weight, g/mol:	188.120115
ΔH_f, kcal/mol:	12.02
Dipole, Da:	3.29
IP(EA), eV:	-8.82(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethoxyethynyl)-4-propylbenzene

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)S/C(=C(\C=C(Cl)Cl)/Cl)/Cl)C

DOS

IR

Vibrations