Geometry & MOs

Info

ID:	121194
PubChem CID:	50758327
Reduced:	N4O5C25H32 (1)
Stoich.:	A4B5C25D32 (1)
Weight, g/mol:	438.226705
ΔH_f, kcal/mol:	-169.16
Dipole, Da:	12.65
IP(EA), eV:	-8.8(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-(cyclopentylcarbamoyl)-7-[(4-ethylphenyl)methyl]-6-methyl-8-oxo-5H-imidazo[1,5-a]pyrazine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)CN2C(=O)C3=C(N=CN3CC2(C)C(=O)NC4CCCC4)C(=O)OC

DOS

IR

Vibrations