Geometry & MOs

Info

ID:	405925
PubChem CID:	135076023
Reduced:	NOH19C20 (1)
Stoich.:	ABC19D20 (1)
Weight, g/mol:	218.112692
ΔH_f, kcal/mol:	26.5
Dipole, Da:	3.97
IP(EA), eV:	-8.7(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[ethyl(dimethyl)silyl]-1-phenylprop-2-yn-1-ol

Drug info:

PubChemData

Smile

CC(=C)CCC1=CN(C2=CC=CC=C21)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations