Geometry & MOs

Info

ID:	65675
PubChem CID:	46386740
Reduced:	OF2N4H14C20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	372.12224
ΔH_f, kcal/mol:	-31.12
Dipole, Da:	2.73
IP(EA), eV:	-8.43(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzodioxol-5-yl)-3-(2-pyridin-3-yl-1H-indol-3-yl)urea

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(N2)C3=CN=CC=C3)NC(=O)NC4=C(C=C(C=C4)F)F

DOS

IR

Vibrations