Geometry & MOs

Info

ID:	294252
PubChem CID:	117443189
Reduced:	ON2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	276.036478
ΔH_f, kcal/mol:	-44.95
Dipole, Da:	2.73
IP(EA), eV:	-8.45(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-chloro-3,5-difluoro-2-methoxyphenyl)cyclopropyl]acetic acid

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCCCN)CN2CCCCC2

DOS

IR

Vibrations