Geometry & MOs

Info

ID:	177929
PubChem CID:	76253483
Reduced:	O2N4C25H28 (1)
Stoich.:	A2B4C25D28 (1)
Weight, g/mol:	483.191797
ΔH_f, kcal/mol:	-10.47
Dipole, Da:	4.81
IP(EA), eV:	-8.69(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-fluoro-5-[3-(4-methyl-2-morpholin-4-yl-6-oxo-5H-pyrimidin-5-yl)propanoylamino]phenyl]-2-methylfuran-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=CC=C(C=C2)CCNC(=O)C(C)NC(=O)C=CC3=CC=CC=C3)C

DOS

IR

Vibrations