Geometry & MOs

Info

ID:	426527
PubChem CID:	135144771
Reduced:	ON2C9H14 (2)
Stoich.:	AB2C9D14 (2)
Weight, g/mol:	380.242356
ΔH_f, kcal/mol:	-58.2
Dipole, Da:	3.36
IP(EA), eV:	-8.84(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(2S)-1-(methoxycarbamoyl)pyrrolidin-2-yl]piperidin-1-yl]-6-azaspiro[3.4]octane-6-carboxylic acid

Drug info:

PubChemData

Smile

CCC1C(CC12CCN(C2)C(=O)O)N3CCC(CC3)C4=CC=NN4

DOS

IR

Vibrations