Geometry & MOs

Info

ID:	180195
PubChem CID:	76594919
Reduced:	NO5C22H33 (1)
Stoich.:	AB5C22D33 (1)
Weight, g/mol:	526.187064
ΔH_f, kcal/mol:	-256.96
Dipole, Da:	4.34
IP(EA), eV:	-9.12(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-[2-[(5-chloro-1H-indole-2-carbonyl)amino]-2,3-dihydro-1H-inden-1-yl]-2-(2-methoxyethyl)propanedioate

Drug info:

PubChemData

Smile

CC(C(=O)OC(C)(C)C)OCC1C(CC2=CC=CC=C12)NC(=O)OC(C)(C)C

DOS

IR

Vibrations