Geometry & MOs

Info

ID:	240780
PubChem CID:	93617517
Reduced:	SN2O3C9H16 (1)
Stoich.:	AB2C3D9E16 (1)
Weight, g/mol:	334.135114
ΔH_f, kcal/mol:	-141.69
Dipole, Da:	6.88
IP(EA), eV:	-9.23(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(3-methoxy-4-propan-2-yloxyphenyl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)CNC(=O)N1CSC[C@@H]1C(=O)O

DOS

IR

Vibrations