Geometry & MOs

Info

ID:	322897
PubChem CID:	126671548
Reduced:	ClFNOC18H19 (1)
Stoich.:	ABCDE18F19 (1)
Weight, g/mol:	190.115779
ΔH_f, kcal/mol:	-67.27
Dipole, Da:	4.06
IP(EA), eV:	-9.48(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(2-fluorophenyl)bicyclo[4.1.0]heptane

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C2=C(C=CC(=C2)C(=O)[C@H](C(C)C)N)Cl)F

DOS

IR

Vibrations