Geometry & MOs

Info

ID:	187881
PubChem CID:	77638054
Reduced:	N2O2C11H14 (2)
Stoich.:	A2B2C11D14 (2)
Weight, g/mol:	228.147393
ΔH_f, kcal/mol:	-134.99
Dipole, Da:	5.04
IP(EA), eV:	-9.28(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(oxan-4-ylamino)piperidine-1-carboxylic acid

Drug info:

PubChemData

Smile

CCC(=O)CCCCCC(C(=O)NC1=CC=CC(=C1)C(=O)C)NC(=O)C2=NC=CN2

DOS

IR

Vibrations