Geometry & MOs

Info

ID:	225909
PubChem CID:	87246412
Reduced:	NPBr2O7H22C24 (1)
Stoich.:	ABC2D7E22F24 (1)
Weight, g/mol:	271.16037
ΔH_f, kcal/mol:	-227.16
Dipole, Da:	5.75
IP(EA), eV:	-8.97(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4,5-didehydro-2,3-dihydropyrrol-1-yl)propyl-triethoxysilane

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C(=C1)Br)OC2=CC(=C(C=C2)O)C(=O)NCC3=CC(=CC=C3)C(=O)OC)Br)(O)P=O

DOS

IR

Vibrations