Geometry & MOs

Info

ID:	58787
PubChem CID:	24714860
Reduced:	SN2O3C18H24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	344.155849
ΔH_f, kcal/mol:	-91.44
Dipole, Da:	3.33
IP(EA), eV:	-8.98(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OCC2=NC(=CS2)CN(CCOC)C(=O)C)C

DOS

IR

Vibrations