Geometry & MOs

Info

ID:	405442
PubChem CID:	135073990
Reduced:	N3H17C19 (1)
Stoich.:	A3B17C19 (1)
Weight, g/mol:	338.170207
ΔH_f, kcal/mol:	113.81
Dipole, Da:	2.88
IP(EA), eV:	-8.22(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[tert-butyl(dimethyl)silyl]oxyphenyl]-3-phenylprop-2-yn-1-ol

Drug info:

PubChemData

Smile

CC1=C(NC2=CC=CC=C12)[N+]3=[C-]N(C=C3)CC4=CC=CC=C4

DOS

IR

Vibrations