Geometry & MOs

Info

ID:	401487
PubChem CID:	135051426
Reduced:	NO2S3H13C14 (1)
Stoich.:	AB2C3D13E14 (1)
Weight, g/mol:	101.060255
ΔH_f, kcal/mol:	-2.58
Dipole, Da:	4.02
IP(EA), eV:	-9.14(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1CCN(C1)C23OC(C(=O)S2)(C(=S)S3)C4=CC=CC=C4

DOS

IR

Vibrations