Geometry & MOs

Info

ID:	155124
PubChem CID:	56320724
Reduced:	SN3O4C20H25 (1)
Stoich.:	AB3C4D20E25 (1)
Weight, g/mol:	423.125277
ΔH_f, kcal/mol:	-144.03
Dipole, Da:	2.72
IP(EA), eV:	-9.26(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-[(3-hydroxybenzoyl)amino]propylcarbamoyl]phenyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCCCNC(=O)C1=CC(=CC=C1)O)NC(=O)C2=CC=CS2

DOS

IR

Vibrations