Geometry & MOs

Info

ID:	240001
PubChem CID:	93375562
Reduced:	N2O3C12H22 (1)
Stoich.:	A2B3C12D22 (1)
Weight, g/mol:	242.163043
ΔH_f, kcal/mol:	-151.75
Dipole, Da:	4.96
IP(EA), eV:	-9.48(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-3-[3-(cyclopropylamino)propanoyl-methylamino]-2-methylpropanoate

Drug info:

PubChemData

Smile

C[C@H](CN(C)C(=O)C1(CCCC1)N)C(=O)OC

DOS

IR

Vibrations