Geometry & MOs

Info

ID:	143643
PubChem CID:	53241281
Reduced:	BrNSO6C20H22 (1)
Stoich.:	ABCD6E20F22 (1)
Weight, g/mol:	346.121483
ΔH_f, kcal/mol:	-191.28
Dipole, Da:	5.45
IP(EA), eV:	-9.17(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[bis(2-chloroethyl)amino]phenyl]-N-hydroxyhexanamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)C(=O)ON(C(=O)OC(C)(C)C)S(=O)(=O)C2=CC=CC=C2Br

DOS

IR

Vibrations