Geometry & MOs

Info

ID:	261638
PubChem CID:	103243046
Reduced:	NO3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	217.167794
ΔH_f, kcal/mol:	-150.05
Dipole, Da:	5.14
IP(EA), eV:	-9.49(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-hydroxy-4-methylpentan-2-yl)amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CCC(=CCNC(CC(C)C)CO)C(=O)O

DOS

IR

Vibrations