Geometry & MOs

Info

ID:	391001
PubChem CID:	135002134
Reduced:	NC19H21 (1)
Stoich.:	AB19C21 (1)
Weight, g/mol:	222.141993
ΔH_f, kcal/mol:	52.63
Dipole, Da:	2.26
IP(EA), eV:	-8.03(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-3-(2-methylphenyl)hept-1-en-3-ol

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](CCN1C2=CC=CC=C2)C(=C)C3=CC=CC=C3

DOS

IR

Vibrations