Geometry & MOs

Info

ID:	189363
PubChem CID:	77844819
Reduced:	Si3N6O6C42H70 (1)
Stoich.:	A3B6C6D42E70 (1)
Weight, g/mol:	445.259009
ΔH_f, kcal/mol:	-445.93
Dipole, Da:	4.06
IP(EA), eV:	-8.74(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-[4-(3-aminopiperidin-1-yl)pyridin-3-yl]-7-piperidin-4-ylquinoline-2-carboxamide

Drug info:

PubChemData

Smile

CCCCC(CC)COC(=O)C1=CC=CC=C1NC2=NC(=NC(=N2)NCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C)NC3=CC=CC=C3C(=O)OCC(CC)CCCC

DOS

IR

Vibrations