Geometry & MOs

Info

ID:	324491
PubChem CID:	126677755
Reduced:	ClN5H20C24 (1)
Stoich.:	AB5C20D24 (1)
Weight, g/mol:	211.087625
ΔH_f, kcal/mol:	125.09
Dipole, Da:	3.89
IP(EA), eV:	-8.45(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-[(4-chlorophenyl)diazenyl]butan-2-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=CC(=C2)CC3=CC(=NC(=C3N=NC4=CC=C(C=C4)Cl)N)N

DOS

IR

Vibrations