Geometry & MOs

Info

ID:	201464
PubChem CID:	79541013
Reduced:	ON2C18H32 (1)
Stoich.:	AB2C18D32 (1)
Weight, g/mol:	309.16079
ΔH_f, kcal/mol:	-76.09
Dipole, Da:	3.81
IP(EA), eV:	-8.57(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[(5-chloro-1-methylimidazol-2-yl)methyl]piperidin-2-yl]cyclohexan-1-one

Drug info:

PubChemData

Smile

C1CCN(CC1)CCN2CCCCC2C3CCCCC3=O

DOS

IR

Vibrations