Geometry & MOs

Info

ID:	313484
PubChem CID:	126614971
Reduced:	SO2N3C26H27 (1)
Stoich.:	AB2C3D26E27 (1)
Weight, g/mol:	239.188529
ΔH_f, kcal/mol:	-14.68
Dipole, Da:	13.4
IP(EA), eV:	-8.32(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2,5,5-tetraethyl-1-hydroxypyrrol-3-yl)ethanone

Drug info:

PubChemData

Smile

CCN(CC)C1=CC=C(C=C1)N2C(=CC(=C2C)/C=C/3\C(=O)N(C(=O)S3)C4=CC=CC=C4)C

DOS

IR

Vibrations