Geometry & MOs

Info

ID:	312852
PubChem CID:	126609237
Reduced:	ON6C14H16 (1)
Stoich.:	AB6C14D16 (1)
Weight, g/mol:	284.138559
ΔH_f, kcal/mol:	36.51
Dipole, Da:	1.06
IP(EA), eV:	-8.97(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-2-N-(4,5,7-trimethyl-1,3-benzoxazol-6-yl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CC1=C(C2=C(C(=C1C)NC3=NC(=NC(=N3)N)C)OC=N2)C

DOS

IR

Vibrations