Geometry & MOs

Info

ID:	368580
PubChem CID:	127329564
Reduced:	OSN6C15H20 (1)
Stoich.:	ABC6D15E20 (1)
Weight, g/mol:	335.257277
ΔH_f, kcal/mol:	40.8
Dipole, Da:	4.48
IP(EA), eV:	-8.91(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-4-oxobutan-2-yl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)C3=CSC(=N3)C4=NC=NN4

DOS

IR

Vibrations