Geometry & MOs

Info

ID:	262578
PubChem CID:	103301974
Reduced:	BrNF3H11C14 (1)
Stoich.:	ABC3D11E14 (1)
Weight, g/mol:	320.043539
ΔH_f, kcal/mol:	-94.96
Dipole, Da:	2.2
IP(EA), eV:	-9.39(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dithian-2-ylmethyl)-3-hydrazinylpyridine-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Br)C(C2=CC(=C(C=C2F)F)F)N

DOS

IR

Vibrations