Geometry & MOs

Info

ID:	373782
PubChem CID:	131320058
Reduced:	NO4C11H11 (1)
Stoich.:	AB4C11D11 (1)
Weight, g/mol:	214.09938
ΔH_f, kcal/mol:	-147.14
Dipole, Da:	6.16
IP(EA), eV:	-10.38(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-hydroxy-1-naphthalen-2-ylbutan-1-one

Drug info:

PubChemData

Smile

C1COC(=O)N[C@@H]1C2=CC=CC=C2C(=O)O

DOS

IR

Vibrations