Geometry & MOs

Info

ID:	27076
PubChem CID:	814269
Reduced:	ClSO2N3C14H14 (1)
Stoich.:	ABC2D3E14F14 (1)
Weight, g/mol:	267.104148
ΔH_f, kcal/mol:	-31.69
Dipole, Da:	4.23
IP(EA), eV:	-9.08(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1=NC=CS1)C(=O)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations