Geometry & MOs

Info

ID:	292737
PubChem CID:	117357528
Reduced:	F2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	242.111836
ΔH_f, kcal/mol:	-202.4
Dipole, Da:	5.2
IP(EA), eV:	-9.59(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[5-(1,1-difluoroethyl)-2-methoxyphenyl]methyl]cyclopropan-1-ol

Drug info:

PubChemData

Smile

CC(CC1=CC=C(C=C1)CCCC(=O)O)(F)F

DOS

IR

Vibrations