Geometry & MOs

Info

ID:	413218
PubChem CID:	135086164
Reduced:	OSeC21H22 (1)
Stoich.:	ABC21D22 (1)
Weight, g/mol:	416.180771
ΔH_f, kcal/mol:	28.75
Dipole, Da:	3.16
IP(EA), eV:	-8.61(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(4-methoxyphenyl)methoxy]phenyl]-1-phenyl-3-trimethylsilylprop-2-yn-1-ol

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)C#CC(CC1=CC=CC=C1)[Se]C2=CC=CC=C2

DOS

IR

Vibrations