Geometry & MOs

Info

ID:	130517
PubChem CID:	51091015
Reduced:	OS2N4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	349.091869
ΔH_f, kcal/mol:	32.69
Dipole, Da:	5.1
IP(EA), eV:	-8.58(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[5-(2-amino-2-oxoethyl)-4-methyl-1,3-thiazol-2-yl]sulfanylmethyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)SCC2=CC(=CC=C2)C(=O)N(C)C

DOS

IR

Vibrations