Geometry & MOs

Info

ID:	324357
PubChem CID:	126677496
Reduced:	FO2N6C26H31 (1)
Stoich.:	AB2C6D26E31 (1)
Weight, g/mol:	315.054132
ΔH_f, kcal/mol:	-37.59
Dipole, Da:	0.69
IP(EA), eV:	-8.34(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-dichlorophenyl) 7-azidoheptanoate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)F)C2=NC3=C(C(NC3)O)C(=C2)N4C=CC(=N4)N5CCC(CC5)N6CCOCC6

DOS

IR

Vibrations