Geometry & MOs

Info

ID:	376578
PubChem CID:	134222598
Reduced:	NOC4H5 (4)
Stoich.:	ABC4D5 (4)
Weight, g/mol:	304.117155
ΔH_f, kcal/mol:	-130.98
Dipole, Da:	3.89
IP(EA), eV:	-8.97(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC1=C(C(=O)N(C(=O)N1)O)C(=O)NCC2=CC(=C(C=C2)C)C

DOS

IR

Vibrations