Geometry & MOs

Info

ID:	389871
PubChem CID:	134995684
Reduced:	ClOC11H19 (1)
Stoich.:	ABC11D19 (1)
Weight, g/mol:	196.182715
ΔH_f, kcal/mol:	-80.23
Dipole, Da:	2.87
IP(EA), eV:	-9.59(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)(C)O[C@@H]1[C@H]2CC[C@H](C2)[C@@H]1Cl

DOS

IR

Vibrations