Geometry & MOs

Info

ID:	125589
PubChem CID:	50928817
Reduced:	N3O6C22H23 (1)
Stoich.:	A3B6C22D23 (1)
Weight, g/mol:	429.109149
ΔH_f, kcal/mol:	-157.38
Dipole, Da:	4.21
IP(EA), eV:	-8.4(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-methoxyphenyl)-2-[4-(2-ethoxyphenyl)-2,3-dioxopyrazin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2C=CN(C(=O)C2=O)CC(=O)NCC3=C(C(=CC=C3)OC)OC

DOS

IR

Vibrations