Geometry & MOs

Info

ID:	132294
PubChem CID:	51337813
Reduced:	N2O2H10C13 (1)
Stoich.:	A2B2C10D13 (1)
Weight, g/mol:	298.131742
ΔH_f, kcal/mol:	57.2
Dipole, Da:	1.96
IP(EA), eV:	-9.16(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(1-cyanocyclopentanecarbonyl)-2,3-dihydroindole-5-carboxylate

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C(=O)NC2=CC=CC(=C2)C#C

DOS

IR

Vibrations