Geometry & MOs

Info

ID:	53338
PubChem CID:	14710489
Reduced:	NC11H13 (1)
Stoich.:	AB11C13 (1)
Weight, g/mol:	291.092915
ΔH_f, kcal/mol:	28.56
Dipole, Da:	2.73
IP(EA), eV:	-8.21(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,3'R,4R,5R)-3'-methyl-2-(4-methylphenyl)sulfanylspiro[6-oxabicyclo[3.1.0]hexane-4,2'-oxirane]-2-yl]formamide

Drug info:

PubChemData

Smile

C/C=C/C1CC2=CC=CC=C2N1

DOS

IR

Vibrations