Geometry & MOs

Info

ID:	22822
PubChem CID:	598864
Reduced:	OH5C6 (2)
Stoich.:	AB5C6 (2)
Weight, g/mol:	186.06808
ΔH_f, kcal/mol:	-47.35
Dipole, Da:	4.24
IP(EA), eV:	-9.03(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-hydroxynaphthalen-2-yl)ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC2=CC=CC=C2C=C1O

DOS

IR

Vibrations