Geometry & MOs

Info

ID:	219087
PubChem CID:	85090469
Reduced:	SN3O5C29H47 (1)
Stoich.:	AB3C5D29E47 (1)
Weight, g/mol:	552.0318
ΔH_f, kcal/mol:	-252.31
Dipole, Da:	12.78
IP(EA), eV:	-9.65(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 3-(phenylselanylmethylidene)-4-(2-phenylselanylpropan-2-yl)cyclopentane-1,1-dicarboxylate

Drug info:

PubChemData

Smile

CCCCC(C=CS(=O)(=O)C1=CC=CC=C1)NC(=O)C(CCC(C)C)NC(=O)C(CCC(C)C)NC(=O)C

DOS

IR

Vibrations