Geometry & MOs

Info

ID:	281651
PubChem CID:	103914170
Reduced:	O2N3C11H23 (1)
Stoich.:	A2B3C11D23 (1)
Weight, g/mol:	216.147393
ΔH_f, kcal/mol:	-124.16
Dipole, Da:	5.27
IP(EA), eV:	-9.55(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]propanoate

Drug info:

PubChemData

Smile

CCC(C)NC(=O)CNC(C(C)C)C(=O)N

DOS

IR

Vibrations