Geometry & MOs

Info

ID:	38144
PubChem CID:	8027406
Reduced:	NC8H17 (1)
Stoich.:	AB8C17 (1)
Weight, g/mol:	338.143056
ΔH_f, kcal/mol:	-28.72
Dipole, Da:	2.14
IP(EA), eV:	-9.06(3.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-7-(2-fluoro-4-formylanilino)-1H-indole-3-carbaldehyde

Drug info:

PubChemData

Smile

CCCC[C@H]1CCNC1

DOS

IR

Vibrations