Geometry & MOs

Info

ID:	273878
PubChem CID:	103805567
Reduced:	FION2C16H16 (1)
Stoich.:	ABCD2E16F16 (1)
Weight, g/mol:	275.109233
ΔH_f, kcal/mol:	-28.74
Dipole, Da:	5.01
IP(EA), eV:	-8.75(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(ethylaminomethyl)phenyl]-2-methyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CCNCC1=CC=CC=C1NC(=O)C2=C(C=C(C=C2)F)I

DOS

IR

Vibrations