Geometry & MOs

Info

ID:	179802
PubChem CID:	76533853
Reduced:	N3O5C22H35 (1)
Stoich.:	A3B5C22D35 (1)
Weight, g/mol:	287.067284
ΔH_f, kcal/mol:	-256.56
Dipole, Da:	3.64
IP(EA), eV:	-9.48(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(5-chloro-4-morpholin-4-yl-6-oxo-5H-pyrimidin-2-yl)acetate

Drug info:

PubChemData

Smile

CCOC(=O)C(CC(C)C)NC(=O)NC(CC1=CC=CC=C1)NC(=O)OC(C)(C)C

DOS

IR

Vibrations