Geometry & MOs

Info

ID:	346813
PubChem CID:	127271317
Reduced:	FN4O4C18H23 (1)
Stoich.:	AB4C4D18E23 (1)
Weight, g/mol:	320.153621
ΔH_f, kcal/mol:	-193.03
Dipole, Da:	2.26
IP(EA), eV:	-9.24(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclohex-3-en-1-ylmethyl)-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]urea

Drug info:

PubChemData

Smile

C1CN(CCC1N2CCNC2=O)C(=O)NCC3=CC(=CC4=C3OCOC4)F

DOS

IR

Vibrations