Geometry & MOs

Info

ID:	27079
PubChem CID:	814276
Reduced:	SN3O3C17H19 (1)
Stoich.:	AB3C3D17E19 (1)
Weight, g/mol:	349.065176
ΔH_f, kcal/mol:	-41.52
Dipole, Da:	3.35
IP(EA), eV:	-9.24(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(cyclopropylmethyl)-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)N(CC2CC2)CC(=O)NC3=NC=CS3

DOS

IR

Vibrations