Geometry & MOs

Info

ID:	369305
PubChem CID:	127332302
Reduced:	S2O3N4C15H26 (1)
Stoich.:	A2B3C4D15E26 (1)
Weight, g/mol:	390.172562
ΔH_f, kcal/mol:	-105.89
Dipole, Da:	4.42
IP(EA), eV:	-9.14(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-morpholin-4-ylsulfonyl-N-(quinolin-8-ylmethyl)piperidin-4-amine

Drug info:

PubChemData

Smile

CCC1=NC(=CS1)CNC2CCN(CC2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations