Geometry & MOs

Info

ID:	131805
PubChem CID:	51263116
Reduced:	SN3O3C17H19 (1)
Stoich.:	AB3C3D17E19 (1)
Weight, g/mol:	365.023705
ΔH_f, kcal/mol:	-58.17
Dipole, Da:	6.79
IP(EA), eV:	-8.71(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[5-(acetamidomethyl)furan-2-yl]-1,3-thiazol-2-yl]-5-chlorofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NCC1=CC=C(O1)C2=CSC(=N2)NC(=O)C3CCC=CC3

DOS

IR

Vibrations