Geometry & MOs

Info

ID:	237965
PubChem CID:	92723208
Reduced:	N5O5C26H35 (1)
Stoich.:	A5B5C26D35 (1)
Weight, g/mol:	458.264154
ΔH_f, kcal/mol:	-157.26
Dipole, Da:	9.85
IP(EA), eV:	-8.65(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-6-N-cyclopentyl-5-ethyl-6-methyl-4-oxo-2-N-[3-(2-oxopyrrolidin-1-yl)propyl]-7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide

Drug info:

PubChemData

Smile

C[C@@]1(CN2C(=CC(=N2)C(=O)NCC3=C(C=C(C=C3)OC)OC)C(=O)N1C)C(=O)NC4CCCCCC4

DOS

IR

Vibrations