Geometry & MOs

Info

ID:	121293
PubChem CID:	50762080
Reduced:	O2S2N3C15H19 (1)
Stoich.:	A2B2C3D15E19 (1)
Weight, g/mol:	325.055484
ΔH_f, kcal/mol:	-43.22
Dipole, Da:	2.46
IP(EA), eV:	-8.43(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-amino-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazol-5-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)C2=C(N(C(=S)S2)CC3=CC=CO3)N

DOS

IR

Vibrations