Geometry & MOs

Info

ID:	46857
PubChem CID:	10527923
Reduced:	SeSiO4C21H36 (1)
Stoich.:	ABC4D21E36 (1)
Weight, g/mol:	459.444015
ΔH_f, kcal/mol:	-255.66
Dipole, Da:	1.95
IP(EA), eV:	-8.77(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-heptyl-2,4-dimethylpyrrol-3-yl)octadecan-1-one

Drug info:

PubChemData

Smile

C[C@]([C@H](CO[Si](C)(C)C(C)(C)C)O)(C(=O)OC(C)(C)C)[Se]C1=CC=CC=C1

DOS

IR

Vibrations