Geometry & MOs

Info

ID:	376575
PubChem CID:	134222595
Reduced:	N3O4C8H11 (1)
Stoich.:	A3B4C8D11 (1)
Weight, g/mol:	460.154683
ΔH_f, kcal/mol:	-136.73
Dipole, Da:	5.12
IP(EA), eV:	-10.02(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-fluoro-5-methylphenyl)methyl]-3-hydroxy-2,4-dioxo-6-(4-phenylanilino)-1H-pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CCNC1=C(C(=O)N(C(=O)N1)O)C(=O)C

DOS

IR

Vibrations