Geometry & MOs

Info

ID:	357014
PubChem CID:	127293080
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	384.227374
ΔH_f, kcal/mol:	-75.29
Dipole, Da:	3.09
IP(EA), eV:	-8.87(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-1-(6-ethoxypyridazin-3-yl)-5-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC2=NC3=C(C=CC(=C3)C(=O)NC4CCN(C4)C5CCCC5)C(=O)N2CC1

DOS

IR

Vibrations