Geometry & MOs

Info

ID:	128322
PubChem CID:	51039286
Reduced:	O2C19H22 (1)
Stoich.:	A2B19C22 (1)
Weight, g/mol:	387.12356
ΔH_f, kcal/mol:	7.82
Dipole, Da:	3.0
IP(EA), eV:	-9.4(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,3'S)-1-benzyl-3'-diethoxyphosphorylspiro[indole-3,2'-oxirane]-2-one

Drug info:

PubChemData

Smile

CCCCCCC#CC(C1=CC=CC=C1C#C)OC(=O)C

DOS

IR

Vibrations