Geometry & MOs

Info

ID:	197891
PubChem CID:	79011697
Reduced:	O2N3C15H23 (1)
Stoich.:	A2B3C15D23 (1)
Weight, g/mol:	230.163043
ΔH_f, kcal/mol:	-76.6
Dipole, Da:	2.7
IP(EA), eV:	-8.79(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[[(2R)-2-amino-3-methylbutanoyl]amino]methyl]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)[C@H](C(=O)NC1=CC=CC=C1N2CCOCC2)N

DOS

IR

Vibrations