Geometry & MOs

Info

ID:	65679
PubChem CID:	46386744
Reduced:	O3N4H18C22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	294.148061
ΔH_f, kcal/mol:	-22.71
Dipole, Da:	3.72
IP(EA), eV:	-8.24(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propan-2-yl-3-(2-pyridin-3-yl-1H-indol-3-yl)urea

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations