Geometry & MOs

Info

ID:	165846
PubChem CID:	74604316
Reduced:	NO2C11H21 (1)
Stoich.:	AB2C11D21 (1)
Weight, g/mol:	201.136493
ΔH_f, kcal/mol:	-107.07
Dipole, Da:	11.37
IP(EA), eV:	-8.99(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-(oxolan-2-ylmethylazaniumyl)butanoate

Drug info:

PubChemData

Smile

CCC(C)(C(=O)[O-])[NH+]1CCCCCC1

DOS

IR

Vibrations