Geometry & MOs

Info

ID:	62614
PubChem CID:	26725279
Reduced:	NSO7C25H27 (1)
Stoich.:	ABC7D25E27 (1)
Weight, g/mol:	489.125751
ΔH_f, kcal/mol:	-221.46
Dipole, Da:	4.08
IP(EA), eV:	-8.22(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[[2-(2-fluorophenoxy)acetyl]amino]-5-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C=C(S1)C2=CC(=C(C(=C2)OC)OC)OC)NC(=O)CC3=CC(=CC=C3)OC

DOS

IR

Vibrations