Geometry & MOs

Info

ID:	146162
PubChem CID:	53645863
Reduced:	ClSN3O6C26H26 (1)
Stoich.:	ABC3D6E26F26 (1)
Weight, g/mol:	324.025475
ΔH_f, kcal/mol:	-175.24
Dipole, Da:	5.79
IP(EA), eV:	-9.07(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dichlorophenyl)-1-(2-phenylethyl)thiourea

Drug info:

PubChemData

Smile

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C(=O)N=C(C3=CC=CC=C3)N)NS(=O)(=O)C4=C(C=CC(=C4)Cl)OC)O)C

DOS

IR

Vibrations