Geometry & MOs

Info

ID:	233220
PubChem CID:	89449354
Reduced:	O2S2N5C30H31 (1)
Stoich.:	A2B2C5D30E31 (1)
Weight, g/mol:	369.986503
ΔH_f, kcal/mol:	57.43
Dipole, Da:	5.86
IP(EA), eV:	-8.42(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-[5-(3,5-dichlorophenyl)-5-methyl-4H-1,2-thiazol-3-yl]aniline

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC2=CSC(=C2)C3=CC4=C(S3)C(=NC=N4)NC5=CC(=CC=C5)OCC6=CC=C(C=C6)OC

DOS

IR

Vibrations