Geometry & MOs

Info

ID:	201032
PubChem CID:	79478874
Reduced:	N5C14H25 (1)
Stoich.:	A5B14C25 (1)
Weight, g/mol:	244.142307
ΔH_f, kcal/mol:	25.0
Dipole, Da:	3.46
IP(EA), eV:	-8.11(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(2-aminoethoxy)acetyl]amino]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCNC1=CN=CC(=N1)N(C)CC2CCCN2CC

DOS

IR

Vibrations