Geometry & MOs

Info

ID:	128695
PubChem CID:	51054358
Reduced:	OSN6C17H20 (1)
Stoich.:	ABC6D17E20 (1)
Weight, g/mol:	293.119798
ΔH_f, kcal/mol:	43.74
Dipole, Da:	5.11
IP(EA), eV:	-9.25(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyethyl)-4-propyl-2-pyrrol-1-yl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C2=NC3=C(CCC3)C(=C12)C(=O)NC4=NN=C(S4)C(C)C)C

DOS

IR

Vibrations