Geometry & MOs

Info

ID:	69832
PubChem CID:	47205499
Reduced:	ClSN2O3C13H17 (1)
Stoich.:	ABC2D3E13F17 (1)
Weight, g/mol:	290.120132
ΔH_f, kcal/mol:	-123.68
Dipole, Da:	5.19
IP(EA), eV:	-8.98(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-imidazol-1-yl-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CN2CCS(=O)(=O)CC2)Cl

DOS

IR

Vibrations