Geometry & MOs

Info

ID:	148610
PubChem CID:	53788278
Reduced:	ClNO2C20H20 (1)
Stoich.:	ABC2D20E20 (1)
Weight, g/mol:	158.13068
ΔH_f, kcal/mol:	-54.62
Dipole, Da:	2.84
IP(EA), eV:	-8.94(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(methoxymethyl)cyclohexyl]methanol

Drug info:

PubChemData

Smile

CCOC(=O)C1C=NC2=C(C1C3=CC=CC=C3Cl)C=C(C(=C2)C)C

DOS

IR

Vibrations