Geometry & MOs

Info

ID:	210913
PubChem CID:	80870641
Reduced:	O3N4C13H14 (1)
Stoich.:	A3B4C13D14 (1)
Weight, g/mol:	268.153541
ΔH_f, kcal/mol:	9.21
Dipole, Da:	5.85
IP(EA), eV:	-9.19(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-6-(oxan-4-yloxy)-N-propyl-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC2=NC(=NC(=C2)C)NC)[N+](=O)[O-]

DOS

IR

Vibrations