Geometry & MOs

Info

ID:	433115
PubChem CID:	135173252
Reduced:	ClNSC8H10 (1)
Stoich.:	ABCD8E10 (1)
Weight, g/mol:	243.048463
ΔH_f, kcal/mol:	49.17
Dipole, Da:	3.72
IP(EA), eV:	-8.78(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(chloromethyl)phenyl]-cyclobutyl-imino-oxo-lambda6-sulfane

Drug info:

PubChemData

Smile

CS(=N)C1=CC=C(C=C1)CCl

DOS

IR

Vibrations