Geometry & MOs

Info

ID:	204270
PubChem CID:	79939316
Reduced:	SN2O2C12H22 (1)
Stoich.:	AB2C2D12E22 (1)
Weight, g/mol:	258.209599
ΔH_f, kcal/mol:	-93.93
Dipole, Da:	7.73
IP(EA), eV:	-8.71(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-propan-2-ylphenyl)methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine

Drug info:

PubChemData

Smile

CC1(CCS(=O)(=O)C1)N2CCN3CCCC3C2

DOS

IR

Vibrations