Geometry & MOs

Info

ID:	440779
PubChem CID:	135231438
Reduced:	SO2F3N4H17C20 (1)
Stoich.:	AB2C3D4E17F20 (1)
Weight, g/mol:	377.131031
ΔH_f, kcal/mol:	-123.12
Dipole, Da:	2.77
IP(EA), eV:	-9.22(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-3-amino-2-methanimidoylprop-2-enyl]-3-[4-(5-phenyl-1,3-thiazol-2-yl)phenyl]urea

Drug info:

PubChemData

Smile

CC1=NC(NN1CC2=CC(=CC=C2)O)C3=NC(=CS3)C4=CC=C(C=C4)OC(F)(F)F

DOS

IR

Vibrations