Geometry & MOs

Info

ID:	255285
PubChem CID:	103131144
Reduced:	N5C12H23 (1)
Stoich.:	A5B12C23 (1)
Weight, g/mol:	265.226646
ΔH_f, kcal/mol:	48.67
Dipole, Da:	3.36
IP(EA), eV:	-8.17(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,4-dimethylpiperazin-2-yl)-(1-methylpyrazol-3-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CNC(C1CN(CCN1C)C)C2=NN(C=C2)C

DOS

IR

Vibrations