Geometry & MOs

Info

ID:	391644
PubChem CID:	135007675
Reduced:	ON3C25H31 (1)
Stoich.:	AB3C25D31 (1)
Weight, g/mol:	335.228056
ΔH_f, kcal/mol:	79.02
Dipole, Da:	1.61
IP(EA), eV:	-8.47(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-3-[1-tri(propan-2-yl)silylpyrrol-3-yl]but-2-enoate

Drug info:

PubChemData

Smile

COC\1=CC(=N/C1=C\C2C=CC(=N2)CCCCC=C)C3=CC=C(N3)CCCC=C

DOS

IR

Vibrations