Geometry & MOs

Info

ID:	201680
PubChem CID:	79569274
Reduced:	N5C16H29 (1)
Stoich.:	A5B16C29 (1)
Weight, g/mol:	294.253195
ΔH_f, kcal/mol:	20.94
Dipole, Da:	5.44
IP(EA), eV:	-8.15(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2-(1,5-dimethylpyrazol-4-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)C(CN)N2CCN(CC2)C3CCCC3

DOS

IR

Vibrations