Geometry & MOs

Info

ID:	380092
PubChem CID:	134964945
Reduced:	SiO3C14H28 (1)
Stoich.:	AB3C14D28 (1)
Weight, g/mol:	179.084527
ΔH_f, kcal/mol:	-177.77
Dipole, Da:	1.51
IP(EA), eV:	-9.4(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-deuterio-4-(2-phenylethynyl)benzene

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)/C=C\C(CCOC)OC(=O)C

DOS

IR

Vibrations