Geometry & MOs

Info

ID:	10883
PubChem CID:	108669
Reduced:	O2H4N4C5 (1)
Stoich.:	A2B4C4D5 (1)
Weight, g/mol:	152.033425
ΔH_f, kcal/mol:	-14.31
Dipole, Da:	5.91
IP(EA), eV:	-10.91(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,6-dioxo-1H-pyrimidin-2-yl)cyanamide

Drug info:

PubChemData

Smile

C1C(=O)NC(=NC1=O)NC#N

DOS

IR

Vibrations