Geometry & MOs

Info

ID:	203456
PubChem CID:	79832654
Reduced:	BrNSH14C17 (1)
Stoich.:	ABCD14E17 (1)
Weight, g/mol:	291.0707
ΔH_f, kcal/mol:	63.53
Dipole, Da:	1.64
IP(EA), eV:	-8.66(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-difluoro-4-formylphenoxy)-N-phenylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C2=CSC(=N2)C3=CC=CC=C3Br

DOS

IR

Vibrations