Geometry & MOs

Info

ID:	205657
PubChem CID:	80132198
Reduced:	BrOSF2N2C12H13 (1)
Stoich.:	ABCD2E2F12G13 (1)
Weight, g/mol:	349.99
ΔH_f, kcal/mol:	-106.21
Dipole, Da:	5.81
IP(EA), eV:	-8.97(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-amino-3-methyl-1-sulfanylidenebutan-2-yl)-4-bromo-2,6-difluorobenzamide

Drug info:

PubChemData

Smile

CCN(CCC(=S)N)C(=O)C1=C(C=C(C=C1F)Br)F

DOS

IR

Vibrations