Geometry & MOs

Info

ID:	397377
PubChem CID:	135030130
Reduced:	NO4C25H29 (1)
Stoich.:	AB4C25D29 (1)
Weight, g/mol:	427.179501
ΔH_f, kcal/mol:	-167.01
Dipole, Da:	1.3
IP(EA), eV:	-8.89(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3R)-5-fluoro-3-(4-methoxyphenyl)-2-oxo-3-(3-oxobutyl)indole-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@@]2(C3=C(C=CC(=C3)C)N(C2=O)C(=O)OC(C)(C)C)CCC(=O)C

DOS

IR

Vibrations