Geometry & MOs

Info

ID:	396127
PubChem CID:	135027505
Reduced:	SnO2C20H42 (1)
Stoich.:	AB2C20D42 (1)
Weight, g/mol:	359.098
ΔH_f, kcal/mol:	-147.63
Dipole, Da:	3.89
IP(EA), eV:	-9.58(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,3R)-2-benzoyl-1'-methyl-3-thiophen-2-ylspiro[cyclopropane-1,3'-indole]-2'-one

Drug info:

PubChemData

Smile

CCCC[Sn](CCCC)(CCCC)/C(=C/[C@@](C)([C@@H](CC)O)O)/C

DOS

IR

Vibrations