Geometry & MOs

Info

ID:	356954
PubChem CID:	127293020
Reduced:	O2N3C23H33 (1)
Stoich.:	A2B3C23D33 (1)
Weight, g/mol:	384.23254
ΔH_f, kcal/mol:	-98.76
Dipole, Da:	5.27
IP(EA), eV:	-8.85(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-2-[1-(4-fluorophenyl)-3,5-dimethylpyrazol-4-yl]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)NC2=CC=CC(=C2)C(=O)NC3CCN(C3)C4CCCC4

DOS

IR

Vibrations