Geometry & MOs

Info

ID:	65637
PubChem CID:	46386701
Reduced:	O3N5C27H29 (1)
Stoich.:	A3B5C27D29 (1)
Weight, g/mol:	358.142976
ΔH_f, kcal/mol:	-20.25
Dipole, Da:	7.47
IP(EA), eV:	-8.53(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(N(C2=C1C(=NC(=N2)C(=O)NCC3=CC(=CC=C3)OC)N4CCOCC4)C5=CC=CC=C5)C

DOS

IR

Vibrations