Geometry & MOs

Info

ID:	322243
PubChem CID:	126669496
Reduced:	OC3H4 (2)
Stoich.:	AB3C4 (2)
Weight, g/mol:	447.140591
ΔH_f, kcal/mol:	-50.32
Dipole, Da:	1.36
IP(EA), eV:	-8.33(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-methoxy-5-(trifluoromethoxy)phenyl]-3-[[2-(pyridin-3-ylmethoxy)phenyl]methyl]urea

Drug info:

PubChemData

Smile

C/C=C\C1=COCO1

DOS

IR

Vibrations