Geometry & MOs

Info

ID:	153961
PubChem CID:	56313317
Reduced:	FN3O4H24C25 (1)
Stoich.:	AB3C4D24E25 (1)
Weight, g/mol:	469.122003
ΔH_f, kcal/mol:	-97.59
Dipole, Da:	4.44
IP(EA), eV:	-8.95(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(E)-3-(3-fluoro-4-pyridin-3-yloxyphenyl)prop-2-enoyl]-2-morpholin-4-yl-1,3-thiazole-4-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F)C

DOS

IR

Vibrations