Geometry & MOs

Info

ID:	367995
PubChem CID:	127326377
Reduced:	ON7C18H29 (1)
Stoich.:	AB7C18D29 (1)
Weight, g/mol:	345.227709
ΔH_f, kcal/mol:	18.19
Dipole, Da:	6.92
IP(EA), eV:	-8.76(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethylpyrazol-3-yl)-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCCN1C(=CC=N1)NC(=O)N2CCN(CC2)CC3=C(N(N=C3C)C)C

DOS

IR

Vibrations