Geometry & MOs

Info

ID:	360314
PubChem CID:	127300957
Reduced:	ON4C21H26 (1)
Stoich.:	AB4C21D26 (1)
Weight, g/mol:	360.252526
ΔH_f, kcal/mol:	-2.68
Dipole, Da:	2.25
IP(EA), eV:	-8.22(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-oxo-4-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]butan-2-yl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C=CC=C2C(=O)N3CCCC3C4=C(N(N=C4C)C)C)C

DOS

IR

Vibrations