Geometry & MOs

Info

ID:	292406
PubChem CID:	115001294
Reduced:	ClFN4H8C10 (1)
Stoich.:	ABC4D8E10 (1)
Weight, g/mol:	238.062139
ΔH_f, kcal/mol:	43.67
Dipole, Da:	5.51
IP(EA), eV:	-9.44(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-ethyl-N-(furan-2-ylmethyl)-1,2,4-triazin-5-amine

Drug info:

PubChemData

Smile

CN(C1=CC(=CC=C1)F)C2=CN=NC(=N2)Cl

DOS

IR

Vibrations