Geometry & MOs

Info

ID:	268381
PubChem CID:	103599181
Reduced:	N3O3H19C21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	264.126263
ΔH_f, kcal/mol:	-60.92
Dipole, Da:	7.26
IP(EA), eV:	-8.76(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-methyl-2,3-dihydroindol-1-yl)-3-pyridin-3-ylprop-2-en-1-one

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=C(C=C2)C=CC(=O)NC3=CC4=C(CNC4=O)C=C3

DOS

IR

Vibrations