Geometry & MOs

Info

ID:	314308
PubChem CID:	126621257
Reduced:	N2O3C9H20 (1)
Stoich.:	A2B3C9D20 (1)
Weight, g/mol:	132.045426
ΔH_f, kcal/mol:	-152.76
Dipole, Da:	1.54
IP(EA), eV:	-9.77(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-chloro-2-(methylamino)butanenitrile

Drug info:

PubChemData

Smile

CC(NCN)OCC(C)(C)C(=O)OC

DOS

IR

Vibrations