Geometry & MOs

Info

ID:	212802
PubChem CID:	81061871
Reduced:	ClON3C11H18 (1)
Stoich.:	ABC3D11E18 (1)
Weight, g/mol:	297.110486
ΔH_f, kcal/mol:	-24.89
Dipole, Da:	6.11
IP(EA), eV:	-8.98(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-methyl-N-(2-propan-2-yloxyethyl)-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CC1=C(N=CN=C1Cl)N(C)CCOC(C)C

DOS

IR

Vibrations