Geometry & MOs

Info

ID:	204275
PubChem CID:	79939976
Reduced:	ON2C13H24 (1)
Stoich.:	AB2C13D24 (1)
Weight, g/mol:	282.129905
ΔH_f, kcal/mol:	-54.28
Dipole, Da:	1.74
IP(EA), eV:	-8.3(2.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-4-fluorophenyl)-3-ethyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C3CCOCC3

DOS

IR

Vibrations