Geometry & MOs

Info

ID:	231184
PubChem CID:	87572894
Reduced:	ClO5C11H15 (1)
Stoich.:	AB5C11D15 (1)
Weight, g/mol:	224.098334
ΔH_f, kcal/mol:	-226.99
Dipole, Da:	1.95
IP(EA), eV:	-10.52(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-hydroxy-2-methylpropan-2-yl)-1-phenylthiourea

Drug info:

PubChemData

Smile

CCOC(=O)C[C@@H](CC(=O)C=CCl)OC(=O)C

DOS

IR

Vibrations