Geometry & MOs

Info

ID:	26213
PubChem CID:	641104
Reduced:	NOC7H15 (1)
Stoich.:	ABC7D15 (1)
Weight, g/mol:	245.001034
ΔH_f, kcal/mol:	-63.71
Dipole, Da:	2.95
IP(EA), eV:	-8.69(2.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dichloro-3-pyrrolidin-1-ylcyclohexa-2,5-diene-1,4-dione

Drug info:

PubChemData

Smile

CCN1CCC[C@@H](C1)O

DOS

IR

Vibrations