Geometry & MOs

Info

ID:	367997
PubChem CID:	127326379
Reduced:	ON5C18H31 (1)
Stoich.:	AB5C18D31 (1)
Weight, g/mol:	319.237211
ΔH_f, kcal/mol:	-38.7
Dipole, Da:	5.6
IP(EA), eV:	-8.52(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CN2CCN(CC2)C(=O)NCC3CCCC3

DOS

IR

Vibrations