Geometry & MOs

Info

ID:	338412
PubChem CID:	127259104
Reduced:	NSO3H11C12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	232.073559
ΔH_f, kcal/mol:	-78.4
Dipole, Da:	5.71
IP(EA), eV:	-9.03(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxynaphthalen-2-yl)oxymethyl acetate

Drug info:

PubChemData

Smile

CC(=O)OCSC1=CC=CC2=C1C(=CN2)C=O

DOS

IR

Vibrations