Geometry & MOs

Info

ID:	197922
PubChem CID:	79016778
Reduced:	ClNOH14C15 (1)
Stoich.:	ABCD14E15 (1)
Weight, g/mol:	296.075012
ΔH_f, kcal/mol:	-5.67
Dipole, Da:	4.68
IP(EA), eV:	-8.56(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methoxy-5-methylaniline

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2CNC3=C(O2)C=CC(=C3)Cl

DOS

IR

Vibrations