Geometry & MOs

Info

ID:	144288
PubChem CID:	53344971
Reduced:	ClOF3N3H27C29 (1)
Stoich.:	ABC3D3E27F29 (1)
Weight, g/mol:	366.205576
ΔH_f, kcal/mol:	-125.93
Dipole, Da:	4.51
IP(EA), eV:	-8.78(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[3-(2-methylphenyl)-8-oxo-6,7-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(CC23CCN(CC3)C/C=C/C4=CC=C(C=C4)C(F)(F)F)C(=O)C5=CC(=NC=C5)Cl

DOS

IR

Vibrations