Geometry & MOs

Info

ID:	129637
PubChem CID:	51073411
Reduced:	N2O2S2C13H16 (1)
Stoich.:	A2B2C2D13E16 (1)
Weight, g/mol:	243.100777
ΔH_f, kcal/mol:	-55.59
Dipole, Da:	4.56
IP(EA), eV:	-8.92(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-phenylmethoxypyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)CN2CSCC2=O)C3=CC=CS3

DOS

IR

Vibrations