Geometry & MOs

Info

ID:	210486
PubChem CID:	80813612
Reduced:	ON6C11H20 (1)
Stoich.:	AB6C11D20 (1)
Weight, g/mol:	301.110965
ΔH_f, kcal/mol:	-9.13
Dipole, Da:	2.0
IP(EA), eV:	-8.97(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-ethyl-6-pyrazol-1-yl-2-N-(thiophen-3-ylmethyl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CN(C)C1=NC(=NC(=N1)NCC2CCCOC2)N

DOS

IR

Vibrations