Geometry & MOs

Info

ID:	229280
PubChem CID:	87567317
Reduced:	NSO4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	1627.433
ΔH_f, kcal/mol:	-125.97
Dipole, Da:	6.31
IP(EA), eV:	-9.86(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-nonadecabromooctan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)ON2CCC(=O)CC2

DOS

IR

Vibrations