Geometry & MOs

Info

ID:	27998
PubChem CID:	824703
Reduced:	ClNOH10C11 (1)
Stoich.:	ABCD10E11 (1)
Weight, g/mol:	226.113984
ΔH_f, kcal/mol:	-10.61
Dipole, Da:	1.1
IP(EA), eV:	-9.1(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-methylimidazol-2-yl)methylsulfanyl]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CCOC1=NC2=CC=CC=C2C(=C1)Cl

DOS

IR

Vibrations