Geometry & MOs

Info

ID:	277895
PubChem CID:	103831698
Reduced:	ON2C13H24 (1)
Stoich.:	AB2C13D24 (1)
Weight, g/mol:	241.179027
ΔH_f, kcal/mol:	-26.6
Dipole, Da:	2.94
IP(EA), eV:	-9.27(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2S)-2-aminohexanoyl]-3,3-dimethylpiperazin-2-one

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N(CC1CC1)C2CC2)N

DOS

IR

Vibrations