Geometry & MOs

Info

ID:	210623
PubChem CID:	80831848
Reduced:	O2N6C11H14 (1)
Stoich.:	A2B6C11D14 (1)
Weight, g/mol:	292.201159
ΔH_f, kcal/mol:	56.37
Dipole, Da:	8.92
IP(EA), eV:	-9.15(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(propylamino)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]amino]cyclobutan-1-ol

Drug info:

PubChemData

Smile

CN1C=CN=C1CN(C)C2=C(C=CC(=N2)N)[N+](=O)[O-]

DOS

IR

Vibrations