Geometry & MOs

Info

ID:	365490
PubChem CID:	127317912
Reduced:	ON3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	363.19582
ΔH_f, kcal/mol:	-51.92
Dipole, Da:	2.99
IP(EA), eV:	-8.61(1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)NCC3CCC3

DOS

IR

Vibrations