Geometry & MOs

Info

ID:	65640
PubChem CID:	46386704
Reduced:	ClON4H15C20 (1)
Stoich.:	ABC4D15E20 (1)
Weight, g/mol:	356.163711
ΔH_f, kcal/mol:	51.57
Dipole, Da:	1.39
IP(EA), eV:	-8.35(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylphenyl)-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=CC=CC=C4Cl

DOS

IR

Vibrations