Geometry & MOs

Info

ID:	378963
PubChem CID:	134228569
Reduced:	O3N4C18H28 (1)
Stoich.:	A3B4C18D28 (1)
Weight, g/mol:	170.147079
ΔH_f, kcal/mol:	-78.68
Dipole, Da:	4.44
IP(EA), eV:	-9.07(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-1-fluorobicyclo[3.2.0]heptane

Drug info:

PubChemData

Smile

CCCCC(C)C1=CC(=C(C=C1)OC)N2C(=O)N(N=N2)CC(C)(C)O

DOS

IR

Vibrations