Geometry & MOs

Info

ID:	315266
PubChem CID:	126625315
Reduced:	NOF6H7C8 (1)
Stoich.:	ABC6D7E8 (1)
Weight, g/mol:	154.09938
ΔH_f, kcal/mol:	-306.86
Dipole, Da:	2.86
IP(EA), eV:	-11.28(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(hydroxymethyl)tricyclo[4.2.0.01,3]octan-6-ol

Drug info:

PubChemData

Smile

CC(C)C1=C(ON=C1C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations