Geometry & MOs

Info

ID:	10309
PubChem CID:	100120
Reduced:	N3O5C12H21 (1)
Stoich.:	A3B5C12D21 (1)
Weight, g/mol:	287.148121
ΔH_f, kcal/mol:	-247.34
Dipole, Da:	2.9
IP(EA), eV:	-10.0(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-(2-acetamidopropanoylamino)propanoylamino]propanoate

Drug info:

PubChemData

Smile

CC(C(=O)NC(C)C(=O)NC(C)C(=O)OC)NC(=O)C

DOS

IR

Vibrations