Geometry & MOs

Info

ID:	311351
PubChem CID:	126590641
Reduced:	O2N5H23C30 (1)
Stoich.:	A2B5C23D30 (1)
Weight, g/mol:	240.137497
ΔH_f, kcal/mol:	106.57
Dipole, Da:	2.35
IP(EA), eV:	-8.61(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-N-(4-prop-1-en-2-ylphenyl)-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

C/C(=N\C(=C)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2)/NC4=CC=C(C=C4)C5=NC6=CC=CC=C6O5

DOS

IR

Vibrations