Geometry & MOs

Info

ID:	217329
PubChem CID:	85087629
Reduced:	N3O3C20H23 (1)
Stoich.:	A3B3C20D23 (1)
Weight, g/mol:	353.217538
ΔH_f, kcal/mol:	-73.52
Dipole, Da:	5.44
IP(EA), eV:	-9.44(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[(4-amino-6-propan-2-yl-1,3,5-triazin-2-yl)amino]carbamoyl]heptyl]-N-hydroxyformamide

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C2=COC3=C2C=C(C=C3)C(=O)NC4CC5CCC4N5

DOS

IR

Vibrations