Geometry & MOs

Info

ID:	382890
PubChem CID:	134974311
Reduced:	CuSi2N4O6C19H40 (1)
Stoich.:	AB2C4D6E19F40 (1)
Weight, g/mol:	290.163043
ΔH_f, kcal/mol:	-183.59
Dipole, Da:	4.27
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.775181
Charge, e:	0

Chem-info

IUPAC name:

(4-methylphenyl)methyl (2S)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoate

Drug info:

PubChemData

Smile

CC1C2CO[Si](O1)(O2)CCC[N-]CCN.CC1C2C(O[Si](O1)(O2)CCC[N-]CCN)C.[Cu+2]

DOS

IR

Vibrations