Geometry & MOs

Info

ID:	58434
PubChem CID:	24701313
Reduced:	O2N3C12H23 (1)
Stoich.:	A2B3C12D23 (1)
Weight, g/mol:	266.050298
ΔH_f, kcal/mol:	-120.43
Dipole, Da:	4.14
IP(EA), eV:	-9.38(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-difluorophenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)N1CCCC(C1)C(=O)N)N

DOS

IR

Vibrations