Geometry & MOs

Info

ID:	313403
PubChem CID:	126614446
Reduced:	NC20H21 (1)
Stoich.:	AB20C21 (1)
Weight, g/mol:	351.048463
ΔH_f, kcal/mol:	49.14
Dipole, Da:	1.0
IP(EA), eV:	-7.9(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-(2-phenyl-2,3-dihydro-1,3-benzothiazol-4-yl)benzaldehyde

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2C=C(C=CN2)C3=CC(=CC(=C3)C)C

DOS

IR

Vibrations