Geometry & MOs

Info

ID:	26081
PubChem CID:	638054
Reduced:	C7H12 (1)
Stoich.:	A7B12 (1)
Weight, g/mol:	124.125201
ΔH_f, kcal/mol:	-2.94
Dipole, Da:	0.38
IP(EA), eV:	-10.24(2.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene

Drug info:

PubChemData

Smile

C1CC[C@H]2C[C@H]2C1

DOS

IR

Vibrations