Geometry & MOs

Info

ID:	132504
PubChem CID:	51371623
Reduced:	ON3H14C15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	322.101408
ΔH_f, kcal/mol:	57.48
Dipole, Da:	5.32
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.094823
Charge, e:	-1

Chem-info

IUPAC name:

2-amino-N-(3,4-dimethylphenyl)-4-phenyl-1,3-thiazole-5-carboximidate

Drug info:

PubChemData

Smile

C[N+]1=C(NC2=CC=CC=C21)NC=C3C=CC=CC3=O

DOS

IR

Vibrations