Geometry & MOs

Info

ID:	142518
PubChem CID:	53049277
Reduced:	SO2N4C28H28 (1)
Stoich.:	AB2C4D28E28 (1)
Weight, g/mol:	484.193297
ΔH_f, kcal/mol:	23.6
Dipole, Da:	7.12
IP(EA), eV:	-8.82(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1N2C(=O)C3=CC(=NN3CC2(C)C(=O)NCC4=CC=C(C=C4)C)C5=CC=CS5

DOS

IR

Vibrations