Geometry & MOs

Info

ID:	206347
PubChem CID:	80235889
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	271.153206
ΔH_f, kcal/mol:	-154.18
Dipole, Da:	3.75
IP(EA), eV:	-9.29(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-3-(2,2,4-trimethyl-3-oxopiperazin-1-yl)propanoic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(O1)CN2CCN(C(=O)C2(C)C)C)C(=O)O

DOS

IR

Vibrations