Geometry & MOs

Info

ID:	210571
PubChem CID:	80823996
Reduced:	N7C13H19 (1)
Stoich.:	A7B13C19 (1)
Weight, g/mol:	281.185175
ΔH_f, kcal/mol:	88.35
Dipole, Da:	6.81
IP(EA), eV:	-9.36(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-N-ethyl-6-(2-methyl-1,4-oxazepan-4-yl)-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CNC1=NC(=NC(=N1)N(C)CC2CCC2)N3C=CN=C3

DOS

IR

Vibrations