Geometry & MOs

Info

ID:	444575
PubChem CID:	135262890
Reduced:	ClSN2O4C25H25 (1)
Stoich.:	ABC2D4E25F25 (1)
Weight, g/mol:	289.095023
ΔH_f, kcal/mol:	-89.83
Dipole, Da:	1.94
IP(EA), eV:	-8.86(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(2'-oxospiro[1,3-dioxolane-2,3'-1H-indole]-5'-yl)cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C2=CC=C(O2)Cl)NC(=O)C3(CC3)C4=CC5=C(C=C4)N(S(=O)(=O)C5)C)C

DOS

IR

Vibrations