Geometry & MOs

Info

ID:	169784
PubChem CID:	75147361
Reduced:	FON2C13H13 (2)
Stoich.:	ABC2D13E13 (2)
Weight, g/mol:	442.22162
ΔH_f, kcal/mol:	-43.88
Dipole, Da:	10.43
IP(EA), eV:	-8.31(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[5-[[3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]furan-2-yl]phenyl]methyl]morpholine-3-carboxamide

Drug info:

PubChemData

Smile

CC1C(ON=C2N1CCCC2=CC3=CC(=C(C=C3)N4C=C(N=C4)C)OC)C5=CC(=CC(=C5)F)F

DOS

IR

Vibrations