Geometry & MOs

Info

ID:	53337
PubChem CID:	14710486
Reduced:	O2C11H12 (1)
Stoich.:	A2B11C12 (1)
Weight, g/mol:	159.104799
ΔH_f, kcal/mol:	-33.24
Dipole, Da:	1.06
IP(EA), eV:	-9.59(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-prop-1-enyl]-2,3-dihydro-1H-indole

Drug info:

PubChemData

Smile

CC(=O)[C@H]1[C@H](O1)CC2=CC=CC=C2

DOS

IR

Vibrations