Geometry & MOs

Info

ID:	163379
PubChem CID:	57900938
Reduced:	ON2C12H12 (2)
Stoich.:	AB2C12D12 (2)
Weight, g/mol:	400.189926
ΔH_f, kcal/mol:	-11.76
Dipole, Da:	5.07
IP(EA), eV:	-8.61(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminophenyl)-1-(benzylcarbamoylamino)-2,3-dihydro-1H-indene-5-carboxamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C(=O)NC2CCC3=C2C=CC(=C3)C(=O)NC4=CC=CC=C4N

DOS

IR

Vibrations