Geometry & MOs

Info

ID:	208514
PubChem CID:	80539570
Reduced:	N2O3C14H20 (1)
Stoich.:	A2B3C14D20 (1)
Weight, g/mol:	244.178693
ΔH_f, kcal/mol:	-126.33
Dipole, Da:	3.97
IP(EA), eV:	-9.04(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(tert-butylamino)propanoylamino]-2-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CCNC(=O)[C@H](CC1=CC=CC=C1)N)C(=O)O

DOS

IR

Vibrations