Geometry & MOs

Info

ID:	145636
PubChem CID:	53562828
Reduced:	BrO2N3H10C15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	341.173942
ΔH_f, kcal/mol:	-2.6
Dipole, Da:	1.25
IP(EA), eV:	-8.88(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[[1-(2-methylphenyl)cyclopropyl]methyl]propanamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CN=C2C(=O)NC3=CC(=CNC3=O)Br

DOS

IR

Vibrations