Geometry & MOs

Info

ID:	264314
PubChem CID:	103453665
Reduced:	ON2C9H10 (1)
Stoich.:	AB2C9D10 (1)
Weight, g/mol:	222.125594
ΔH_f, kcal/mol:	8.25
Dipole, Da:	2.44
IP(EA), eV:	-9.03(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethoxyphenyl)-2-hydroxypentan-1-one

Drug info:

PubChemData

Smile

C=CC(=O)CC1=C(N=CC=C1)N

DOS

IR

Vibrations