Geometry & MOs

Info

ID:	201320
PubChem CID:	79525170
Reduced:	NO3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	298.189257
ΔH_f, kcal/mol:	-182.36
Dipole, Da:	5.83
IP(EA), eV:	-9.95(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[4-(hydroxymethyl)piperidine-1-carbonyl]amino]methyl]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)CCC(=O)NCC1CCC(CC1)C(=O)O

DOS

IR

Vibrations