Geometry & MOs

Info

ID:	397714
PubChem CID:	135030608
Reduced:	O5C14H22 (1)
Stoich.:	A5B14C22 (1)
Weight, g/mol:	322.120509
ΔH_f, kcal/mol:	-239.44
Dipole, Da:	2.4
IP(EA), eV:	-9.9(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-hydroxy-5-methoxy-4-phenylnaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C/C=C/1\[C@H](O[C@H]2[C@@H]1OC(O2)(C)C)[C@H]3COC(O3)(C)C

DOS

IR

Vibrations