Geometry & MOs

Info

ID:	65729
PubChem CID:	46386797
Reduced:	O3N4H20C22 (1)
Stoich.:	A3B4C20D22 (1)
Weight, g/mol:	372.158626
ΔH_f, kcal/mol:	-15.47
Dipole, Da:	4.41
IP(EA), eV:	-8.19(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethoxyphenyl)-3-(2-pyridin-4-yl-1H-indol-3-yl)urea

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)NC2=C(NC3=CC=CC=C32)C4=CC=NC=C4)OC

DOS

IR

Vibrations