Geometry & MOs

Info

ID:	293969
PubChem CID:	117420478
Reduced:	ClO2F3H10C11 (1)
Stoich.:	AB2C3D10E11 (1)
Weight, g/mol:	266.032142
ΔH_f, kcal/mol:	-211.15
Dipole, Da:	2.94
IP(EA), eV:	-9.48(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-chloro-4-methoxy-5-(trifluoromethyl)phenyl]cyclopropan-1-ol

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C(F)(F)F)C2(CC2)O)Cl

DOS

IR

Vibrations