Geometry & MOs

Info

ID:	57804
PubChem CID:	24277468
Reduced:	SN2C13H16 (1)
Stoich.:	AB2C13D16 (1)
Weight, g/mol:	222.062698
ΔH_f, kcal/mol:	27.26
Dipole, Da:	1.63
IP(EA), eV:	-8.89(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-fluorophenyl)-2-methyl-1,3-thiazol-5-yl]methanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2=C(SC(=N2)C)CN)C

DOS

IR

Vibrations