Geometry & MOs

Info

ID:	125580
PubChem CID:	50928808
Reduced:	N3O4C16H19 (1)
Stoich.:	A3B4C16D19 (1)
Weight, g/mol:	413.114234
ΔH_f, kcal/mol:	-124.66
Dipole, Da:	4.72
IP(EA), eV:	-8.65(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)NC(=O)CN1C=CN(C(=O)C1=O)C2=CC=CC=C2OC

DOS

IR

Vibrations