Geometry & MOs

Info

ID:	261142
PubChem CID:	103219547
Reduced:	ON5C13H19 (1)
Stoich.:	AB5C13D19 (1)
Weight, g/mol:	397.96829
ΔH_f, kcal/mol:	23.09
Dipole, Da:	6.4
IP(EA), eV:	-9.16(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[amino-(3-chloro-4-iodophenyl)methyl]-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

CC(C)NC1=CC(=O)N(N=C1)CCC2=CN(N=C2)C

DOS

IR

Vibrations