Geometry & MOs

Info

ID:	262077
PubChem CID:	103268452
Reduced:	O2N3C8H19 (1)
Stoich.:	A2B3C8D19 (1)
Weight, g/mol:	256.142307
ΔH_f, kcal/mol:	-111.97
Dipole, Da:	3.3
IP(EA), eV:	-9.7(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[1-(hydroxymethyl)cyclopropyl]amino]acetyl]piperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CCCC(CNCC(C(=O)N)N)O

DOS

IR

Vibrations