Geometry & MOs

Info

ID:	54011
PubChem CID:	14719478
Reduced:	O3N6C14H22 (1)
Stoich.:	A3B6C14D22 (1)
Weight, g/mol:	331.153206
ΔH_f, kcal/mol:	-69.65
Dipole, Da:	11.75
IP(EA), eV:	-9.31(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-(hydroxymethyl)-4-(1-phenylethyl)morpholin-2-yl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCCCN1CC(OC(C1)N2C=NC3=C2NC(=NC3=O)N)CO

DOS

IR

Vibrations