Geometry & MOs

Info

ID:	231516
PubChem CID:	87574003
Reduced:	ON2C5H11 (2)
Stoich.:	AB2C5D11 (2)
Weight, g/mol:	280.049333
ΔH_f, kcal/mol:	-96.16
Dipole, Da:	1.91
IP(EA), eV:	-9.68(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1-aminoethyl)-2,3,6-trifluorophenyl]ethenesulfonamide

Drug info:

PubChemData

Smile

C(CCCC(=N)N)CCCC(C(=N)N)(O)O

DOS

IR

Vibrations