Geometry & MOs

Info

ID:	57802
PubChem CID:	24277463
Reduced:	NS2O3H9C13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	218.08777
ΔH_f, kcal/mol:	-26.89
Dipole, Da:	5.53
IP(EA), eV:	-9.19(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CSC(=C1)C2=CSC(=N2)CC3=CC=C(O3)C(=O)O

DOS

IR

Vibrations