Geometry & MOs

Info

ID:	402369
PubChem CID:	135055689
Reduced:	O2C9H10 (2)
Stoich.:	A2B9C10 (2)
Weight, g/mol:	225.15175
ΔH_f, kcal/mol:	-124.33
Dipole, Da:	2.83
IP(EA), eV:	-9.59(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-3-ethenyl-2,3,4-trimethyl-1,2-dihydrocyclopenta[b]indole

Drug info:

PubChemData

Smile

COC(=O)C1(CC(CC(=C1)C2=CC=CC=C2)C=C)C(=O)OC

DOS

IR

Vibrations