Geometry & MOs

Info

ID:	262315
PubChem CID:	103284183
Reduced:	NO3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	239.163377
ΔH_f, kcal/mol:	-161.72
Dipole, Da:	3.14
IP(EA), eV:	-9.55(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpentyl (2R)-2-amino-3-(1H-imidazol-5-yl)propanoate

Drug info:

PubChemData

Smile

CCCC(C)COC(=O)[C@@H]1C[C@H](CN1)O

DOS

IR

Vibrations