Geometry & MOs

Info

ID:	434938
PubChem CID:	135176036
Reduced:	O4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	312.153701
ΔH_f, kcal/mol:	-160.96
Dipole, Da:	5.19
IP(EA), eV:	-9.32(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2,2-difluoro-2-[4-(4-methylcyclohexyl)oxyphenyl]acetate

Drug info:

PubChemData

Smile

CCOC(=O)C(=O)C1=CC=C(C=C1)OC2CCC(CC2)C

DOS

IR

Vibrations