Geometry & MOs

Info

ID:	139734
PubChem CID:	52586377
Reduced:	N4O4C25H28 (1)
Stoich.:	A4B4C25D28 (1)
Weight, g/mol:	438.124943
ΔH_f, kcal/mol:	-151.02
Dipole, Da:	7.79
IP(EA), eV:	-9.14(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[2-[2-(methylcarbamoyl)phenoxy]acetyl]amino]-4-phenylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H](CN(C1)C(=O)C2=CC=CC=C2NC(=O)CCN3C4=CC=CC=C4C(=O)NC3=O)C

DOS

IR

Vibrations