Geometry & MOs

Info

ID:	383618
PubChem CID:	134975430
Reduced:	Cl2O2C11H12 (1)
Stoich.:	A2B2C11D12 (1)
Weight, g/mol:	245.141579
ΔH_f, kcal/mol:	-92.83
Dipole, Da:	3.96
IP(EA), eV:	-9.45(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R)-2-(5-methoxy-1H-indol-3-yl)cyclohexan-1-ol

Drug info:

PubChemData

Smile

CC(C)(CC1(OC2=CC=CC=C2O1)Cl)Cl

DOS

IR

Vibrations