Geometry & MOs

Info

ID:	125567
PubChem CID:	50928612
Reduced:	SN2O4H20C21 (1)
Stoich.:	AB2C4D20E21 (1)
Weight, g/mol:	379.153206
ΔH_f, kcal/mol:	-116.43
Dipole, Da:	5.02
IP(EA), eV:	-9.1(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dimethylphenyl)-2-[4-(2-methoxyphenyl)-2,3-dioxopyrazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=O)N1CC(=O)NC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C

DOS

IR

Vibrations