Geometry & MOs

Info

ID:	27544
PubChem CID:	821924
Reduced:	O3N5C10H11 (1)
Stoich.:	A3B5C10D11 (1)
Weight, g/mol:	298.059841
ΔH_f, kcal/mol:	50.09
Dipole, Da:	4.05
IP(EA), eV:	-10.04(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(benzylsulfanyl)methylidenecyanamide

Drug info:

PubChemData

Smile

CC1=NN=NN1CC2=CC(=C(C=C2)OC)[N+](=O)[O-]

DOS

IR

Vibrations