Geometry & MOs

Info

ID:	170191
PubChem CID:	75206007
Reduced:	N3O5C16H21 (1)
Stoich.:	A3B5C16D21 (1)
Weight, g/mol:	424.125692
ΔH_f, kcal/mol:	-183.79
Dipole, Da:	3.53
IP(EA), eV:	-9.07(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(4-fluorophenyl)thiophen-2-yl]-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]prop-2-enamide

Drug info:

PubChemData

Smile

CN(CC1=C(C(=CC=C1)OC)OC)C(=O)CN2CCC(=O)NC2=O

DOS

IR

Vibrations