Geometry & MOs

Info

ID:	69762
PubChem CID:	47205340
Reduced:	O2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	269.152812
ΔH_f, kcal/mol:	-72.86
Dipole, Da:	4.12
IP(EA), eV:	-9.69(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanopropyl)-N,2,3-trimethyl-1H-indole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)C(=O)NCC(=O)N2CCCCC2

DOS

IR

Vibrations