Geometry & MOs

Info

ID:	172460
PubChem CID:	75512593
Reduced:	NOF2H6C7 (2)
Stoich.:	ABC2D6E7 (2)
Weight, g/mol:	336.184921
ΔH_f, kcal/mol:	-229.13
Dipole, Da:	2.31
IP(EA), eV:	-9.25(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dioxaspiro[4.5]decan-8-yl)-3-[2-(4-fluoro-2-methylphenyl)ethyl]urea

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CCOC(=O)C2=C(C(=CC=C2)C(F)(F)F)F

DOS

IR

Vibrations