Geometry & MOs

Info

ID:	60791
PubChem CID:	26702238
Reduced:	SN2O4H18C21 (1)
Stoich.:	AB2C4D18E21 (1)
Weight, g/mol:	408.114378
ΔH_f, kcal/mol:	-84.0
Dipole, Da:	4.84
IP(EA), eV:	-8.7(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-benzamidophenyl) 4-(thiophene-3-carbonylamino)butanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)OC(=O)CCNC(=O)C3=CSC=C3

DOS

IR

Vibrations