Geometry & MOs

Info

ID:	21354
PubChem CID:	587990
Reduced:	ClO3N4H9C11 (1)
Stoich.:	AB3C4D9E11 (1)
Weight, g/mol:	280.036318
ΔH_f, kcal/mol:	-74.94
Dipole, Da:	2.89
IP(EA), eV:	-9.42(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-chlorophenyl)-2,4-dioxo-1H-pyrimidine-6-carbohydrazide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NNC(=O)C2=CC(=O)NC(=O)N2)Cl

DOS

IR

Vibrations