Geometry & MOs

Info

ID:	121120
PubChem CID:	50756544
Reduced:	O3N4H28C29 (1)
Stoich.:	A3B4C28D29 (1)
Weight, g/mol:	464.221226
ΔH_f, kcal/mol:	-8.98
Dipole, Da:	3.63
IP(EA), eV:	-8.53(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-6-methyl-5-[(2-methylphenyl)methyl]-4-oxo-2-phenyl-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=O)C3=CC(=NN3CC2(C)C(=O)NCC4=CC=CC=C4)C5=CC=C(C=C5)OC

DOS

IR

Vibrations