Geometry & MOs

Info

ID:	379940
PubChem CID:	134964381
Reduced:	NO2C15H15 (1)
Stoich.:	AB2C15D15 (1)
Weight, g/mol:	212.156501
ΔH_f, kcal/mol:	-32.08
Dipole, Da:	4.84
IP(EA), eV:	-10.02(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-2-butyl-1-prop-1-en-2-yl-1H-indene

Drug info:

PubChemData

Smile

C1CC(=O)[C@](C1)(CCC(=O)C2=CC=CC=C2)C#N

DOS

IR

Vibrations