Geometry & MOs

Info

ID:	408838
PubChem CID:	135081608
Reduced:	SN3H9C11 (1)
Stoich.:	AB3C9D11 (1)
Weight, g/mol:	277.067369
ΔH_f, kcal/mol:	100.12
Dipole, Da:	3.39
IP(EA), eV:	-9.0(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl-(4-phenyl-1,3-thiazol-2-yl)cyanamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)N(C#N)C2=CC=CC=C2

DOS

IR

Vibrations