Geometry & MOs

Info

ID:	14105
PubChem CID:	404525
Reduced:	N4O5H8C11 (1)
Stoich.:	A4B5C8D11 (1)
Weight, g/mol:	276.049469
ΔH_f, kcal/mol:	-42.67
Dipole, Da:	5.82
IP(EA), eV:	-9.7(-2.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[3-(dihydroxyamino)-6-oxocyclohexa-2,4-dien-1-ylidene]methylimino]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=O)C(=CN=C2C=NC(=O)NC2=O)C=C1N(O)O

DOS

IR

Vibrations