Geometry & MOs

Info

ID:	159798
PubChem CID:	57288761
Reduced:	ON3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	378.230728
ΔH_f, kcal/mol:	-17.52
Dipole, Da:	5.03
IP(EA), eV:	-8.27(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[3-(tert-butylamino)propoxy]phenyl]-3-(1H-indol-3-yl)propan-1-one

Drug info:

PubChemData

Smile

C1CCN(C1)C2CCC3=C(C2)C4=C(N3)C=CC(=C4)NC=O

DOS

IR

Vibrations