Geometry & MOs

Info

ID:	266407
PubChem CID:	103565144
Reduced:	NO2C12H21 (1)
Stoich.:	AB2C12D21 (1)
Weight, g/mol:	254.163043
ΔH_f, kcal/mol:	-105.07
Dipole, Da:	3.53
IP(EA), eV:	-9.03(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-oxo-1-(3-propan-2-ylcyclobutyl)piperazin-2-yl]acetic acid

Drug info:

PubChemData

Smile

CCC1(CCN(C1)C2CC(C2)C)C(=O)O

DOS

IR

Vibrations