Geometry & MOs

Info

ID:	275219
PubChem CID:	103814664
Reduced:	ON3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	251.199762
ΔH_f, kcal/mol:	-65.57
Dipole, Da:	4.25
IP(EA), eV:	-8.84(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-[(2S)-piperidin-2-yl]methanone

Drug info:

PubChemData

Smile

CCC[C@H](C(=O)N1CC2CCCN2CC1C)N

DOS

IR

Vibrations