Geometry & MOs

Info

ID:	151597
PubChem CID:	55161584
Reduced:	SN2O3C11H18 (1)
Stoich.:	AB2C3D11E18 (1)
Weight, g/mol:	268.046649
ΔH_f, kcal/mol:	-115.89
Dipole, Da:	2.07
IP(EA), eV:	-9.63(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-4-methylphenyl)-(2,4-difluorophenyl)methanol

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CCCS(=O)(=O)C)C)C(=O)C

DOS

IR

Vibrations