Geometry & MOs

Info

ID:	38417
PubChem CID:	8036336
Reduced:	OSN3C21H21 (1)
Stoich.:	ABC3D21E21 (1)
Weight, g/mol:	314.088912
ΔH_f, kcal/mol:	47.23
Dipole, Da:	1.34
IP(EA), eV:	-7.87(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCC1=C2C(=CC=C1)C(=CN2)C3=CSC(=N3)NCC4=CC=CC=C4OC

DOS

IR

Vibrations