Geometry & MOs

Info

ID:	394454
PubChem CID:	135023018
Reduced:	NC15H15 (1)
Stoich.:	AB15C15 (1)
Weight, g/mol:	378.194343
ΔH_f, kcal/mol:	163.84
Dipole, Da:	1.4
IP(EA), eV:	-9.12(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[(E)-2-acetamidoprop-1-enyl]-2,3-dihydroindol-1-yl]propyl benzoate

Drug info:

PubChemData

Smile

C1C2C=CC1C3[C@H]2C4C5=CC=CC=C5C3N4

DOS

IR

Vibrations