Geometry & MOs

Info

ID:	292794
PubChem CID:	117358878
Reduced:	ClN2O2C11H15 (1)
Stoich.:	AB2C2D11E15 (1)
Weight, g/mol:	242.107358
ΔH_f, kcal/mol:	-35.61
Dipole, Da:	2.11
IP(EA), eV:	-8.74(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-2-methoxy-5-propan-2-ylphenyl)propan-1-ol

Drug info:

PubChemData

Smile

C1COCCN1C2=C(C=C(C=C2)CON)Cl

DOS

IR

Vibrations