Geometry & MOs

Info

ID:	399216
PubChem CID:	135038806
Reduced:	OC2H4 (4)
Stoich.:	AB2C4 (4)
Weight, g/mol:	382.00007
ΔH_f, kcal/mol:	-205.81
Dipole, Da:	4.77
IP(EA), eV:	-10.61(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-[(2-iodophenyl)methyl]thiourea

Drug info:

PubChemData

Smile

CC(C)OC(=O)[C@](C)(CCO)O

DOS

IR

Vibrations