Geometry & MOs

Info

ID:	383183
PubChem CID:	134974755
Reduced:	NSiO2C20H31 (1)
Stoich.:	ABC2D20E31 (1)
Weight, g/mol:	160.052429
ΔH_f, kcal/mol:	-107.0
Dipole, Da:	2.1
IP(EA), eV:	-8.18(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-hydroxyphenyl)but-3-yn-2-one

Drug info:

PubChemData

Smile

C/C=C(/C=C(\OC)/O[Si](C)(C)C1=CC=CC=C1)\N2[C@H](CC[C@@H]2C)C

DOS

IR

Vibrations