Geometry & MOs

Info

ID:	353169
PubChem CID:	127284349
Reduced:	ON4C23H24 (1)
Stoich.:	AB4C23D24 (1)
Weight, g/mol:	389.279075
ΔH_f, kcal/mol:	40.98
Dipole, Da:	4.76
IP(EA), eV:	-9.09(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[[1-(3-methyl-2-piperidin-1-ylbutanoyl)piperidin-4-yl]methyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C1C(=O)N3CCC(CC3)C4=NC(=NN4)C5=CC=CC=C5

DOS

IR

Vibrations