Geometry & MOs

Info

ID:	335585
PubChem CID:	127254447
Reduced:	SO2N4C17H18 (1)
Stoich.:	AB2C4D17E18 (1)
Weight, g/mol:	277.124883
ΔH_f, kcal/mol:	-11.73
Dipole, Da:	9.91
IP(EA), eV:	-8.29(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,3-thiazol-2-yl)-6-pyrrol-1-ylhexanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=C2CSCC2=NN1C)N3CC4=CC=CC=C4C3=O

DOS

IR

Vibrations