Geometry & MOs

Info

ID:	275548
PubChem CID:	103816559
Reduced:	OSCl2N2C9H10 (1)
Stoich.:	ABC2D2E9F10 (1)
Weight, g/mol:	182.141913
ΔH_f, kcal/mol:	-15.71
Dipole, Da:	3.62
IP(EA), eV:	-9.48(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3S)-3-aminopyrrolidin-1-yl]-2-cyclobutylethanone

Drug info:

PubChemData

Smile

C1CN(C[C@H]1N)C(=O)C2=C(SC(=C2)Cl)Cl

DOS

IR

Vibrations