Geometry & MOs

Info

ID:	56601
PubChem CID:	17487160
Reduced:	O3N5C25H25 (1)
Stoich.:	A3B5C25D25 (1)
Weight, g/mol:	415.136591
ΔH_f, kcal/mol:	-34.07
Dipole, Da:	6.8
IP(EA), eV:	-7.94(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[3-methyl-1-[[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methylamino]-1-oxobutan-2-yl]benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC2=C(C=CC=N2)C(=O)N3CCC(CC3)N4C5=CC=CC=C5NC4=O

DOS

IR

Vibrations