Geometry & MOs

Info

ID:	372583
PubChem CID:	131300280
Reduced:	NO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	163.099714
ΔH_f, kcal/mol:	-96.37
Dipole, Da:	2.62
IP(EA), eV:	-7.67(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2,6-dimethyl-2,3-dihydro-1H-indol-4-ol

Drug info:

PubChemData

Smile

C[C@@H]1CC2=C(N1)C(=C(C=C2OC)OC)OC

DOS

IR

Vibrations