Geometry & MOs

Info

ID:	380055
PubChem CID:	134964814
Reduced:	O2C11H20 (1)
Stoich.:	A2B11C20 (1)
Weight, g/mol:	189.078979
ΔH_f, kcal/mol:	-99.89
Dipole, Da:	0.92
IP(EA), eV:	-9.77(1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1aS,7aS)-1a,3-dimethyl-1H-cyclopropa[c]indole-2,5-dione

Drug info:

PubChemData

Smile

CC(=C)C[C@H](C[C@@H](CC(=C)C)O)O

DOS

IR

Vibrations