Geometry & MOs

Info

ID:	357997
PubChem CID:	127295511
Reduced:	ON2C9H15 (2)
Stoich.:	AB2C9D15 (2)
Weight, g/mol:	381.252861
ΔH_f, kcal/mol:	-52.31
Dipole, Da:	6.47
IP(EA), eV:	-8.94(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-(3-piperidin-1-ylpyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NOC(=C1)NC(=O)CN2CCC(C2)N3CCCCC3

DOS

IR

Vibrations