Geometry & MOs

Info

ID:	271138
PubChem CID:	103644961
Reduced:	N2O3C10H18 (1)
Stoich.:	A2B3C10D18 (1)
Weight, g/mol:	204.101111
ΔH_f, kcal/mol:	-108.88
Dipole, Da:	1.7
IP(EA), eV:	-9.9(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CCC#N)C(=O)COCCOC

DOS

IR

Vibrations