Geometry & MOs

Info

ID:	255853
PubChem CID:	103135207
Reduced:	N5C16H21 (1)
Stoich.:	A5B16C21 (1)
Weight, g/mol:	258.184447
ΔH_f, kcal/mol:	80.69
Dipole, Da:	6.15
IP(EA), eV:	-8.73(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methylpyrazol-3-yl)-N-propyl-3-pyridin-3-ylpropan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CN1C=NC2=CC=CC=C21)C3=NN(C=C3)C

DOS

IR

Vibrations