Geometry & MOs

Info

ID:	78733
PubChem CID:	49703987
Reduced:	O2N3H21C22 (1)
Stoich.:	A2B3C21D22 (1)
Weight, g/mol:	373.179027
ΔH_f, kcal/mol:	5.86
Dipole, Da:	6.87
IP(EA), eV:	-8.48(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-methyl-1-(2-methyl-2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-6-phenylpyridazin-3-one

Drug info:

PubChemData

Smile

CC(C)(C(=O)N1CCC2=CC=CC=C21)N3C(=O)C=CC(=N3)C4=CC=CC=C4

DOS

IR

Vibrations