Geometry & MOs

Info

ID:	155081
PubChem CID:	56320661
Reduced:	ClN2O3C19H19 (1)
Stoich.:	AB2C3D19E19 (1)
Weight, g/mol:	380.080633
ΔH_f, kcal/mol:	-49.57
Dipole, Da:	4.21
IP(EA), eV:	-9.07(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-[3-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN(C)C(=O)C2=CC(=C(C=C2OC)N3C=CC=C3)Cl

DOS

IR

Vibrations