Geometry & MOs

Info

ID:	222341
PubChem CID:	85297048
Reduced:	O8C19H32 (1)
Stoich.:	A8B19C32 (1)
Weight, g/mol:	392.12545
ΔH_f, kcal/mol:	-370.72
Dipole, Da:	5.79
IP(EA), eV:	-9.8(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 7,7a-dimethyl-2-phenylselanyl-3,3a,4,5,6,7-hexahydro-1H-indene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C=C=C1C(CC(CC1(C)O)OC2C(C(C(C(O2)CO)O)O)O)(C)C)O

DOS

IR

Vibrations