Geometry & MOs

Info

ID:	46018
PubChem CID:	10520474
Reduced:	SiO2C20H30 (1)
Stoich.:	AB2C20D30 (1)
Weight, g/mol:	330.022977
ΔH_f, kcal/mol:	-94.49
Dipole, Da:	3.66
IP(EA), eV:	-8.69(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-amino-5-chloro-1-cyano-1-thiophen-3-ylindene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCC#CCCC(=O)CCC1=CC=CC=C1

DOS

IR

Vibrations