Geometry & MOs

Info

ID:	381794
PubChem CID:	134972624
Reduced:	OC4H4 (4)
Stoich.:	AB4C4 (4)
Weight, g/mol:	310.133572
ΔH_f, kcal/mol:	-129.61
Dipole, Da:	3.46
IP(EA), eV:	-9.07(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(3-chloropropyl)-2-hydroxy-4-methyl-5,6,7,8-tetrahydronaphthalene-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC2=CC=CC=C2)C)C(=O)OC)O

DOS

IR

Vibrations