Geometry & MOs

Info

ID:	147731
PubChem CID:	53787388
Reduced:	N3O6C30H31 (1)
Stoich.:	A3B6C30D31 (1)
Weight, g/mol:	254.134051
ΔH_f, kcal/mol:	-191.83
Dipole, Da:	4.81
IP(EA), eV:	-8.85(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dibutoxy-2-ethenylthiophene

Drug info:

PubChemData

Smile

CCC(=O)OC1=CC=CC(=C1)CC(=O)N2[C@@H]([C@@H](CC2C3=CC=CC=C3)C(=O)NC(=O)N)C4=CC=CC=C4OC

DOS

IR

Vibrations