Geometry & MOs

Info

ID:	1858
PubChem CID:	5216
Reduced:	ClN5C7H12 (1)
Stoich.:	AB5C7D12 (1)
Weight, g/mol:	201.078123
ΔH_f, kcal/mol:	27.62
Dipole, Da:	4.68
IP(EA), eV:	-9.4(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-2-N,4-N-diethyl-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC(=N1)Cl)NCC

DOS

IR

Vibrations