Geometry & MOs

Info

ID:	216057
PubChem CID:	85085643
Reduced:	O3C13H16 (1)
Stoich.:	A3B13C16 (1)
Weight, g/mol:	220.121178
ΔH_f, kcal/mol:	-104.59
Dipole, Da:	2.85
IP(EA), eV:	-9.69(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(6-oxo-3H-pyridin-3-yl)cyclohexyl]formamide

Drug info:

PubChemData

Smile

CC=CC(C(C1=CC=CC=C1)O)C(=O)OC

DOS

IR

Vibrations