Geometry & MOs

Info

ID:	58783
PubChem CID:	24714855
Reduced:	SN2O2C17H22 (1)
Stoich.:	AB2C2D17E22 (1)
Weight, g/mol:	346.171499
ΔH_f, kcal/mol:	-49.29
Dipole, Da:	5.12
IP(EA), eV:	-8.84(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(3,4-dimethylphenoxy)methyl]-1,3-thiazol-4-yl]methyl]-N-(2-methylpropyl)acetamide

Drug info:

PubChemData

Smile

CCCN(CC1=CSC(=N1)COC2=CC=C(C=C2)C)C(=O)C

DOS

IR

Vibrations