Geometry & MOs

Info

ID:	263485
PubChem CID:	103371206
Reduced:	NSF5H6C10 (1)
Stoich.:	ABC5D6E10 (1)
Weight, g/mol:	325.97002
ΔH_f, kcal/mol:	-197.62
Dipole, Da:	2.06
IP(EA), eV:	-9.57(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-bromophenyl)sulfanylmethyl]-3,3,3-trifluoropropanimidamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1SCC(C#N)C(F)(F)F)F)F

DOS

IR

Vibrations