Geometry & MOs

Info

ID:	57384
PubChem CID:	22395807
Reduced:	O4N5C10H15 (1)
Stoich.:	A4B5C10D15 (1)
Weight, g/mol:	186.136828
ΔH_f, kcal/mol:	-145.64
Dipole, Da:	11.75
IP(EA), eV:	-9.62(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-(4-aminocyclohexyl)propanoic acid

Drug info:

PubChemData

Smile

C1=NC(=O)NC(=C1CC(=O)N(CCN)CC(=O)O)N

DOS

IR

Vibrations