Geometry & MOs

Info

ID:	197151
PubChem CID:	78929432
Reduced:	O2N4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	294.180424
ΔH_f, kcal/mol:	35.9
Dipole, Da:	8.54
IP(EA), eV:	-9.14(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CN1CCC(CC1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

DOS

IR

Vibrations