Geometry & MOs

Info

ID:	157957
PubChem CID:	56459346
Reduced:	F3N3O4C19H22 (1)
Stoich.:	A3B3C4D19E22 (1)
Weight, g/mol:	475.192963
ΔH_f, kcal/mol:	-329.57
Dipole, Da:	10.82
IP(EA), eV:	-9.08(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-2-methylphenyl]-3-(morpholin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2CCC3(CC2)C(=O)NC(=O)N3

DOS

IR

Vibrations