Geometry & MOs

Info

ID:	366292
PubChem CID:	127319749
Reduced:	O2F3N4C19H19 (1)
Stoich.:	A2B3C4D19E19 (1)
Weight, g/mol:	290.174276
ΔH_f, kcal/mol:	-185.59
Dipole, Da:	3.67
IP(EA), eV:	-9.44(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-oxoethyl]azocan-2-one

Drug info:

PubChemData

Smile

C1CN2C=CN=C2CN1C(=O)C3CC(=O)N(C3)CC4=CC(=CC=C4)C(F)(F)F

DOS

IR

Vibrations