Geometry & MOs

Info

ID:	247667
PubChem CID:	103072616
Reduced:	BrON3C15H18 (1)
Stoich.:	ABC3D15E18 (1)
Weight, g/mol:	287.02694
ΔH_f, kcal/mol:	2.87
Dipole, Da:	3.92
IP(EA), eV:	-9.23(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-1-[2-(ethylaminomethyl)prop-2-enyl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)NCC(=C)CN1C=NC2=C(C1=O)C=C(C=C2)Br

DOS

IR

Vibrations