Geometry & MOs

Info

ID:	364529
PubChem CID:	127315781
Reduced:	N2O2C13H22 (1)
Stoich.:	A2B2C13D22 (1)
Weight, g/mol:	297.168856
ΔH_f, kcal/mol:	-125.97
Dipole, Da:	1.94
IP(EA), eV:	-9.85(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCC(C(C1)C)NC(=O)[C@H]2CCC(=O)N2

DOS

IR

Vibrations