Geometry & MOs

Info

ID:	153210
PubChem CID:	56312370
Reduced:	SO2N5C21H25 (1)
Stoich.:	AB2C5D21E25 (1)
Weight, g/mol:	433.182398
ΔH_f, kcal/mol:	1.89
Dipole, Da:	7.54
IP(EA), eV:	-8.3(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[2-[benzyl(cyclobutylmethyl)amino]acetyl]amino]phenyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(CC1=CN(N=C1)C)CC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3

DOS

IR

Vibrations