Geometry & MOs

Info

ID:	296934
PubChem CID:	117601928
Reduced:	Cl2N2C9H22 (1)
Stoich.:	A2B2C9D22 (1)
Weight, g/mol:	216.183778
ΔH_f, kcal/mol:	-101.74
Dipole, Da:	6.71
IP(EA), eV:	-8.95(1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-diaminopropyl)octanoic acid

Drug info:

PubChemData

Smile

CCC1C(CCCN1CC)N.Cl.Cl

DOS

IR

Vibrations