Geometry & MOs

Info

ID:	220897
PubChem CID:	85240308
Reduced:	ON2C18H24 (1)
Stoich.:	AB2C18D24 (1)
Weight, g/mol:	284.144616
ΔH_f, kcal/mol:	-2.67
Dipole, Da:	1.69
IP(EA), eV:	-8.75(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,2,3-trimethylcyclopent-3-en-1-yl)acetyl]sulfanylethyl propanoate

Drug info:

PubChemData

Smile

CCC(C(C1=CC=CC=C1)NCC2=CC=C(C=C2)OC)N

DOS

IR

Vibrations