Geometry & MOs

Info

ID:	19474
PubChem CID:	564777
Reduced:	NOC12H15 (1)
Stoich.:	ABC12D15 (1)
Weight, g/mol:	189.115364
ΔH_f, kcal/mol:	-29.04
Dipole, Da:	3.29
IP(EA), eV:	-9.73(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(pyridin-2-ylmethyl)cyclohexan-1-one

Drug info:

PubChemData

Smile

C1CCC(=O)C(C1)CC2=CC=CC=N2

DOS

IR

Vibrations