Geometry & MOs

Info

ID:	125570
PubChem CID:	50928798
Reduced:	ClFN3O4H15C19 (1)
Stoich.:	ABC3D4E15F19 (1)
Weight, g/mol:	429.03242
ΔH_f, kcal/mol:	-134.56
Dipole, Da:	7.77
IP(EA), eV:	-8.84(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromophenyl)-2-[4-(2-methoxyphenyl)-2,3-dioxopyrazin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2C=CN(C(=O)C2=O)CC(=O)NC3=C(C=C(C=C3)Cl)F

DOS

IR

Vibrations