Geometry & MOs

Info

ID:	294548
PubChem CID:	117469132
Reduced:	O4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	290.070972
ΔH_f, kcal/mol:	-148.73
Dipole, Da:	5.85
IP(EA), eV:	-9.34(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-chloro-2-hydroxynaphthalen-1-yl)-3-cyclopropylpropanoic acid

Drug info:

PubChemData

Smile

CC1(COC1)COC2=CC=CC(=C2)C3(CCCC3)C(=O)O

DOS

IR

Vibrations