Geometry & MOs

Info

ID:	283821
PubChem CID:	104011329
Reduced:	FO2N3H14C15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	259.087625
ΔH_f, kcal/mol:	-10.05
Dipole, Da:	8.7
IP(EA), eV:	-9.39(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(6-chloropyridin-2-yl)-2,3-dihydro-1H-indene-1,3-diamine

Drug info:

PubChemData

Smile

C1C(C2=CC=CC=C2C1NC3=CC(=C(C=C3)[N+](=O)[O-])F)N

DOS

IR

Vibrations