Geometry & MOs

Info

ID:	222441
PubChem CID:	85300744
Reduced:	O2N5H11C18 (1)
Stoich.:	A2B5C11D18 (1)
Weight, g/mol:	329.126323
ΔH_f, kcal/mol:	123.78
Dipole, Da:	12.34
IP(EA), eV:	-9.16(-2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(4-methoxyphenyl)-5-methyl-2,3-dioxo-7,7a-dihydro-4H-indole-3a-carboxylate

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C3C2=NNC(=C4C=C5C=CC=NC5=NC4=O)O3

DOS

IR

Vibrations