Geometry & MOs

Info

ID:	214941
PubChem CID:	85083892
Reduced:	SBr2O2N3H21C30 (1)
Stoich.:	AB2C2D3E21F30 (1)
Weight, g/mol:	648.14342
ΔH_f, kcal/mol:	79.97
Dipole, Da:	3.84
IP(EA), eV:	-8.33(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dipropan-2-yl 3,4-bis(3-trimethylstannylprop-1-enyl)cyclopentane-1,1-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C=C2C(=O)N(C(S2)C3=CC=CC=C3Br)NC(=O)CN4C5=CC=CC=C5C6=CC=CC=C64)Br

DOS

IR

Vibrations