Geometry & MOs

Info

ID:	399293
PubChem CID:	135039456
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	223.1361
ΔH_f, kcal/mol:	23.98
Dipole, Da:	1.99
IP(EA), eV:	-9.51(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-cyclopenta-2,4-dien-1-ylethyl)-7-methyl-1H-indole

Drug info:

PubChemData

Smile

CC1(C2CCC1([C@H]3C2OC(=N3)C=C)C)C

DOS

IR

Vibrations