Geometry & MOs

Info

ID:	6654
PubChem CID:	69413
Reduced:	N3C4H5 (1)
Stoich.:	A3B4C5 (1)
Weight, g/mol:	95.048347
ΔH_f, kcal/mol:	63.92
Dipole, Da:	2.86
IP(EA), eV:	-10.48(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyanomethylamino)acetonitrile

Drug info:

PubChemData

Smile

C(C#N)NCC#N

DOS

IR

Vibrations