Geometry & MOs

Info

ID:	209577
PubChem CID:	80689362
Reduced:	ClON6C10H13 (1)
Stoich.:	ABC6D10E13 (1)
Weight, g/mol:	232.132411
ΔH_f, kcal/mol:	43.85
Dipole, Da:	4.13
IP(EA), eV:	-9.55(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CCNC2=NC(=NC(=N2)Cl)OC

DOS

IR

Vibrations