Geometry & MOs

Info

ID:	238377
PubChem CID:	92741000
Reduced:	O3N4C25H30 (1)
Stoich.:	A3B4C25D30 (1)
Weight, g/mol:	434.231791
ΔH_f, kcal/mol:	-48.26
Dipole, Da:	7.12
IP(EA), eV:	-8.8(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-2-(furan-2-yl)-6-methyl-N-(3-methylbutyl)-5-[(3-methylphenyl)methyl]-4-oxo-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C(=O)C3=CC(=NN3C[C@]2(C)C(=O)NCCC(C)C)C4=CC=CO4

DOS

IR

Vibrations