Geometry & MOs

Info

ID:	223360
PubChem CID:	85334912
Reduced:	ON2H12C16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	249.093583
ΔH_f, kcal/mol:	146.4
Dipole, Da:	2.78
IP(EA), eV:	-8.59(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[4-(2-methylprop-2-enoxy)phenyl]methylideneamino]thiourea

Drug info:

PubChemData

Smile

C1=CC(=C2C=CC3=CC=CC4=NN=C(C34)C2=C1)CO

DOS

IR

Vibrations