Geometry & MOs

Info

ID:	408831
PubChem CID:	135081601
Reduced:	INSC8H10 (1)
Stoich.:	ABCD8E10 (1)
Weight, g/mol:	467.108223
ΔH_f, kcal/mol:	44.46
Dipole, Da:	4.54
IP(EA), eV:	-8.54(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CSC1=C(C=CC=CC1I)N

DOS

IR

Vibrations