Geometry & MOs

Info

ID:	284699
PubChem CID:	104061931
Reduced:	ClNSO3C10H14 (1)
Stoich.:	ABCD3E10F14 (1)
Weight, g/mol:	283.168462
ΔH_f, kcal/mol:	-114.74
Dipole, Da:	3.12
IP(EA), eV:	-9.68(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(3-propan-2-yloxypyridin-2-yl)-2,3-dihydro-1H-indene-1,5-diamine

Drug info:

PubChemData

Smile

CC(CS(=O)(=O)C1=C(C=CC=N1)OC)CCl

DOS

IR

Vibrations