Geometry & MOs

Info

ID:	4390
PubChem CID:	11337
Reduced:	ClNO2C5H11 (2)
Stoich.:	ABC2D5E11 (2)
Weight, g/mol:	304.095663
ΔH_f, kcal/mol:	-223.07
Dipole, Da:	2.03
IP(EA), eV:	-9.53(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,6-bis(2-chloroethylamino)hexane-2,3,4,5-tetrol

Drug info:

PubChemData

Smile

C(CCl)NCC(C(C(C(CNCCCl)O)O)O)O

DOS

IR

Vibrations