Geometry & MOs

Info

ID:	406382
PubChem CID:	135077399
Reduced:	ClO2H15C18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	252.118401
ΔH_f, kcal/mol:	4.63
Dipole, Da:	2.24
IP(EA), eV:	-8.74(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-2-methoxy-2-phenylsulfanylethanol

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C#C/C=C\C(C2=CC=C(C=C2)Cl)O

DOS

IR

Vibrations