Geometry & MOs

Info

ID:	34863
PubChem CID:	7979024
Reduced:	SN2O4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	363.080826
ΔH_f, kcal/mol:	-160.47
Dipole, Da:	3.41
IP(EA), eV:	-9.08(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzyl-1-[[2-(4-chlorophenoxy)acetyl]amino]-1-methylthiourea

Drug info:

PubChemData

Smile

CC[C@H](C)NC(=O)COC(=O)[C@H]1CS[C@@]2(N1C(=O)CC2)C3=CC=CC=C3

DOS

IR

Vibrations