Geometry & MOs

Info

ID:	151630
PubChem CID:	55161770
Reduced:	NSO3C13H21 (1)
Stoich.:	ABC3D13E21 (1)
Weight, g/mol:	254.174276
ΔH_f, kcal/mol:	-121.79
Dipole, Da:	5.38
IP(EA), eV:	-8.73(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,4-dimethylpentan-2-amine

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C(CCCS(=O)(=O)C)N

DOS

IR

Vibrations