Geometry & MOs

Info

ID:	65641
PubChem CID:	46386705
Reduced:	ON4H20C22 (1)
Stoich.:	AB4C20D22 (1)
Weight, g/mol:	362.093439
ΔH_f, kcal/mol:	47.31
Dipole, Da:	2.41
IP(EA), eV:	-8.31(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)NC2=C(NC3=CC=CC=C32)C4=CN=CC=C4

DOS

IR

Vibrations