Geometry & MOs

Info

ID:	360002
PubChem CID:	127300146
Reduced:	FN2O2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	392.13184
ΔH_f, kcal/mol:	-118.88
Dipole, Da:	3.38
IP(EA), eV:	-9.01(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-fluoro-3,4-dihydro-2H-chromen-4-yl)-3-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]urea

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)NC2CCOC3=C2C=C(C=C3)F

DOS

IR

Vibrations