Geometry & MOs

Info

ID:	210932
PubChem CID:	80873103
Reduced:	SO2N4C14H16 (1)
Stoich.:	AB2C4D14E16 (1)
Weight, g/mol:	260.127326
ΔH_f, kcal/mol:	44.9
Dipole, Da:	5.84
IP(EA), eV:	-9.0(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-6-(3-phenylpropoxy)-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CCCNC1=NC=C(C(=N1)SC2=CC=C(C=C2)[N+](=O)[O-])C

DOS

IR

Vibrations