Geometry & MOs

Info

ID:	261592
PubChem CID:	103241579
Reduced:	O2N3H9C10 (1)
Stoich.:	A2B3C9D10 (1)
Weight, g/mol:	222.136828
ΔH_f, kcal/mol:	-20.22
Dipole, Da:	3.95
IP(EA), eV:	-9.66(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclohexylmethoxy)-2-methyl-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)OC2=CC(=O)NC=N2

DOS

IR

Vibrations