Geometry & MOs

Info

ID:	82203
PubChem CID:	49855755
Reduced:	SN4O4C32H32 (1)
Stoich.:	AB4C4D32E32 (1)
Weight, g/mol:	566.235162
ΔH_f, kcal/mol:	-79.12
Dipole, Da:	7.68
IP(EA), eV:	-8.72(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-morpholin-4-yl-4-oxo-1H-quinolin-8-yl)dibenzothiophen-1-yl]-3-piperidin-1-ylpropanamide

Drug info:

PubChemData

Smile

C1COCCN1CCC(=O)NC2=C3C4=CC=CC=C4SC3=C(C=C2)C5=CC=CC6=C5NC(=CC6=O)N7CCOCC7

DOS

IR

Vibrations