Geometry & MOs

Info

ID:	145424
PubChem CID:	53522387
Reduced:	O2N5H15C17 (1)
Stoich.:	A2B5C15D17 (1)
Weight, g/mol:	331.153206
ΔH_f, kcal/mol:	29.33
Dipole, Da:	7.43
IP(EA), eV:	-9.1(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2)CC(=O)NC3=CN=C(C=C3)N4C=NC=N4

DOS

IR

Vibrations