Geometry & MOs

Info

ID:	352885
PubChem CID:	127283975
Reduced:	S2N3O5C14H19 (1)
Stoich.:	A2B3C5D14E19 (1)
Weight, g/mol:	339.136511
ΔH_f, kcal/mol:	-189.35
Dipole, Da:	8.58
IP(EA), eV:	-9.85(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-(methylamino)-N-[2-[2-(methylcarbamoyl)pyrrolidin-1-yl]-2-oxoethyl]-1,2-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCS(=O)(=O)CC1)NC(=O)CNC(=O)C2=CSC=C2

DOS

IR

Vibrations