Geometry & MOs

Info

ID:	325289
PubChem CID:	126682499
Reduced:	FO3N4C23H25 (1)
Stoich.:	AB3C4D23E25 (1)
Weight, g/mol:	438.201553
ΔH_f, kcal/mol:	-126.05
Dipole, Da:	5.98
IP(EA), eV:	-8.77(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[4-(6-methoxypyridazine-3-carbonyl)piperidin-1-yl]-4-oxobutyl]-3-methyl-7H-imidazo[1,5-a]pyrazin-8-one

Drug info:

PubChemData

Smile

CC1=NC=C2N1C=C(NC2=O)CCCC(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations