Geometry & MOs

Info

ID:	269983
PubChem CID:	103621697
Reduced:	SN2O2C11H12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	277.092578
ΔH_f, kcal/mol:	-40.16
Dipole, Da:	5.16
IP(EA), eV:	-8.84(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dihydroxy-N-propan-2-yl-N-(2,2,2-trifluoroethyl)benzamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC2=C(C=C1)N=CS2)OC

DOS

IR

Vibrations