Geometry & MOs

Info

ID:	389624
PubChem CID:	134994171
Reduced:	NOC4H6 (2)
Stoich.:	ABC4D6 (2)
Weight, g/mol:	213.058798
ΔH_f, kcal/mol:	-39.41
Dipole, Da:	5.9
IP(EA), eV:	-10.81(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S)-1-carboxy-2-trimethylsilyloxyethyl]azanium;chloride

Drug info:

PubChemData

Smile

CC[C@H]1[C@H](N1C(=O)OCC)C#N

DOS

IR

Vibrations