Geometry & MOs

Info

ID:	402178
PubChem CID:	135054732
Reduced:	NPO4C31H40 (1)
Stoich.:	ABC4D31E40 (1)
Weight, g/mol:	217.110279
ΔH_f, kcal/mol:	-198.03
Dipole, Da:	4.69
IP(EA), eV:	-8.54(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(2-methoxyethenyl)-1,3-dimethylindol-2-one

Drug info:

PubChemData

Smile

CCCCOC(=O)C[C@@](C)(C1=CC=C(C=C1)OC)NP(=O)(C2=CC(=CC(=C2)C)C)C3=CC(=CC(=C3)C)C

DOS

IR

Vibrations