Geometry & MOs

Info

ID:	328387
PubChem CID:	126705745
Reduced:	OSN7C27H35 (1)
Stoich.:	ABC7D27E35 (1)
Weight, g/mol:	379.225977
ΔH_f, kcal/mol:	56.1
Dipole, Da:	2.97
IP(EA), eV:	-8.54(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(Z)-(5-tert-butyl-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-N-propyl-1H-pyrrole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC1)NC2=CC(=NC(=N2)SC3=CC=C(C=C3)NC(=O)C4CC4)N5CCN(CC5)C(C)(C)C

DOS

IR

Vibrations