Geometry & MOs

Info

ID:	17510
PubChem CID:	502423
Reduced:	N4O5H18C24 (1)
Stoich.:	A4B5C18D24 (1)
Weight, g/mol:	442.12772
ΔH_f, kcal/mol:	-94.29
Dipole, Da:	3.34
IP(EA), eV:	-9.03(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-4-oxo-2-[3-[(2-phenylphenyl)carbamoylamino]phenyl]-1H-pyrimidine-6-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=CC=C2NC(=O)NC3=CC=CC(=C3)C4=NC(=O)C(=C(N4)C(=O)O)O

DOS

IR

Vibrations