Geometry & MOs

Info

ID:	353097
PubChem CID:	127284254
Reduced:	O3N5C16H21 (1)
Stoich.:	A3B5C16D21 (1)
Weight, g/mol:	295.128054
ΔH_f, kcal/mol:	-45.61
Dipole, Da:	5.08
IP(EA), eV:	-8.9(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethyl-2,3-dioxopiperazin-1-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)C2=NC=C(C=C2)C(=O)NCC3=NC(=NO3)C

DOS

IR

Vibrations