Geometry & MOs

Info

ID:	264233
PubChem CID:	103444751
Reduced:	Cl2N4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	292.145474
ΔH_f, kcal/mol:	32.52
Dipole, Da:	4.44
IP(EA), eV:	-8.74(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-chloropyridin-2-yl)-(1-propylpyrazol-4-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CC1=C(C(=NN1C)C)Cl)C2=C(C=CC=N2)Cl

DOS

IR

Vibrations